SCHEMBL2970236

SCHEMBL2970236

COC(=O)c1ccc2sc(C)nc2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.71
RAB9A P51151 7/20 0.71
SMN1; SMN2 Q16637 5/20 0.71
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
RXFP1 Q9HBX9 2/20 0.60
TRPV1 Q8NER1 1/20 0.53
PIK3CA P42336 1/20 0.51
PIK3CB P42338 1/20 0.51
PIK3CG P48736 1/20 0.51
PI4KB Q9UBF8 1/20 0.51
ALDH1A1 P00352 1/20 0.51
HSD17B10 Q99714 1/20 0.50
MAPT P10636 2/20 0.48
HDAC4 P56524 1/20 0.48
LMNA P02545 3/20 0.48
KDM4E B2RXH2 2/20 0.48
TNF P01375 1/20 0.48
GAA P10253 1/20 0.48
HPGD P15428 1/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31120903 1.00 NPC1 (0.71) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL16809339 0.88 RAB9A (0.76) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL31398710 0.84 HDAC1 (0.51) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL5787140 0.84 RAB9A (0.74) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL1105986 0.83 NPC1 (1.00) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL1121389 0.83 NPC1 (0.50) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL9305296 0.83 PIK3CA (0.50) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL1121708 0.83 CYP3A4 (0.57) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL20481983 0.82 NPC1 (0.78) NPC1RAB9ASMN1; SMN2TRPV1ALDH1A1
SCHEMBL24052027 0.81 RAB9A (0.71) NPC1RAB9ASMN1; SMN2MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250066344-A1 BENZOTHIAZOLE, BENZOISOXAZOLE, AND BENZODIOXOLE ANALOGS AS RXFP1 RECEPTOR AGONISTS BRISTOL MYERS SQUIBB CO (US) 2025-02-27 US disclosed
EP-4448500-A1 BENZOTHIAZOLE, BENZOISOXAZOLE AND BENZODIOXOLE ANALOGS AS RXFP1 RECEPTOR AGONISTS Bristol-Myers Squibb Company (US) 2024-10-23 EP disclosed
CN-118401502-A Benzothiazole, benzisoxazole and benzodioxole analogs as RXFP1 receptor agonists 百时美施贵宝公司 2024-07-26 CN disclosed
US-11779578-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-10-10 US disclosed
US-20230234953-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-07-27 US disclosed
US-11707457-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-07-25 US disclosed
WO-2023114822-A1 BENZOTHIAZOLE, BENZOISOXAZOLE AND BENZODIOXOLE ANALOGS AS RXFP1 RECEPTOR AGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-06-22 WO disclosed
US-20230144292-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-11 US disclosed
EP-3394052-B1 BICYCLIC HYDROXAMIC ACIDS USEFUL AS INHIBITORS OF MAMMALIAN HISTONE DEACETYLASE ACTIVITY KANCERA AB (SE) 2021-07-28 EP disclosed
EP-2594555-B1 HETEROCYCLIC COMPOUND, AND p27 KIP1 DEGRADATION INHIBITOR ASKA PHARM CO LTD (JP) 2018-03-07 EP disclosed
US-20130237525-A1 LACTAM DERIVATIVES USEFUL AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2013-09-12 US disclosed
EP-1445249-B1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO LTD (JP) 2012-11-07 EP disclosed
US-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed
US-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed
WO-2009114079-A1 INFRARED DYE FOR SILVER HALIDE-BASED PHOTOGRAPHIC ELEMENTS EASTMAN KODAK COMPANY (US) 2009-09-17 WO disclosed
US-20090233247-A1 INFRARED DYE FOR SILVER HALIDE-BASED PHOTOGRAPHIC ELEMENTS EASTMAN KODAK COMPANY 2009-09-17 US disclosed
US-20090234131-A1 INFRARED DYE FOR SILVER HALIDE-BASED PHOTOGRAPHIC ELEMENTS EASTMAN KODAK COMPANY (US) 2009-09-17 US disclosed
US-20070105890-A1 Novel condensed imidazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD 2007-05-10 US disclosed
US-20050113400-A1 Inhibitors of transcription factor AP-1; autoimmune diseases; rheumatoid arthritis; high safety and excellent pharmacokinetics in vivo SHUNICHI SHIOZAWA (JP) 2005-05-26 US disclosed
EP-1445249-A1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2004-08-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070105890-A1 Novel condensed imidazole derivative DPP4, DPP7, DPP3 NPC1 1232/4885RAB9A 1156/4885SMN1; SMN2 3321/4885
US-20230234953-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 NPC1 3159/4885RAB9A 4270/4885SMN1; SMN2 2647/4885
US-20130237525-A1 LACTAM DERIVATIVES USEFUL AS OREXIN RECEPTOR ANTAGONISTS HCRTR2, HCRTR1, NPY1R NPC1 1359/4885RAB9A 1662/4885SMN1; SMN2 1960/4885
US-20090234131-A1 INFRARED DYE FOR SILVER HALIDE-BASED PHOTOGRAPHIC ELEMENTS IK, HTT, HYPK NPC1 1822/4885RAB9A 2873/4885SMN1; SMN2 3523/4885
US-20090233247-A1 INFRARED DYE FOR SILVER HALIDE-BASED PHOTOGRAPHIC ELEMENTS IK, HYPK, HTT NPC1 1665/4885RAB9A 3063/4885SMN1; SMN2 3697/4885
US-11779578-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 NPC1 3159/4885RAB9A 4270/4885SMN1; SMN2 2647/4885
US-20050113400-A1 Inhibitors of transcription factor AP-1; autoimmune diseases; rheumatoid arthritis; high safety and excellent pharmacokinetics in vivo SP1, AP1G1, JUN NPC1 1513/4885RAB9A 1645/4885SMN1; SMN2 4165/4885
US-20250066344-A1 BENZOTHIAZOLE, BENZOISOXAZOLE, AND BENZODIOXOLE ANALOGS AS RXFP1 RECEPTOR AGONISTS RXFP1, RXFP2, RXFP3 NPC1 2042/4885RAB9A 3464/4885SMN1; SMN2 4394/4885
US-11707457-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 NPC1 3159/4885RAB9A 4270/4885SMN1; SMN2 2647/4885
US-20230144292-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 NPC1 3159/4885RAB9A 4270/4885SMN1; SMN2 2647/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.