SCHEMBL275863

SCHEMBL275863

Cc1nc(-c2ccccc2)c(C(=O)O)s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 4/20 0.59
CDC7 O00311 2/20 0.58
DBF4 Q9UBU7 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.56
ALDH1A1 P00352 3/20 0.50
PTGS1 P23219 2/20 0.50
PTGS2 P35354 2/20 0.50
HPGD P15428 1/20 0.50
HSD17B10 Q99714 1/20 0.49
RARA P10276 1/20 0.49
RARB P10826 1/20 0.49
RARG P13631 1/20 0.49
CCNE1 P24864 1/20 0.48
CDK2 P24941 1/20 0.48
RAB9A P51151 2/20 0.47
RECQL P46063 1/20 0.47
ALOX5 P09917 1/20 0.47
ADAMTS5 Q9UNA0 1/20 0.46
GAA P10253 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL27729658 0.89 NTRK1 (0.59) NTRK1CDC7DBF4SMN1; SMN2ALDH1A1
SCHEMBL1398786 0.88 GAA (0.57) NTRK1CDC7DBF4SMN1; SMN2ALDH1A1
SCHEMBL956697 0.88 CDC7 (0.61) NTRK1CDC7DBF4SMN1; SMN2ALDH1A1
SCHEMBL10242392 0.88 KMT2A (0.58) NTRK1CDC7DBF4SMN1; SMN2ALDH1A1
SCHEMBL13494028 0.86 CDC7 (0.63) NTRK1CDC7DBF4SMN1; SMN2CCNE1
SCHEMBL13494131 0.86 RARA (0.54) NTRK1CDC7DBF4SMN1; SMN2ALDH1A1
SCHEMBL1398685 0.85 MAPK14 (0.52) NTRK1CDC7DBF4SMN1; SMN2ALDH1A1
SCHEMBL10242397 0.85 ADORA3 (0.61) NTRK1SMN1; SMN2ALDH1A1ALOX5HTT
SCHEMBL1398715 0.85 PTGDR2 (0.62) NTRK1CDC7DBF4SMN1; SMN2ALDH1A1
SCHEMBL1339569 0.85 PTGS2 (0.54) NTRK1CDC7DBF4SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12024509-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor C4X DISCOVERY LIMITED (GB) 2024-07-02 US disclosed
US-20220324814-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPEUTICS INC (US) 2022-10-13 US disclosed
US-11339130-B1 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2022-05-24 US disclosed
US-11339130-B1 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2022-05-24 US disclosed
CN-107074808-B Therapeutic compounds as orexin-1 receptor inhibitors 希四克斯探索有限公司 2021-03-02 CN disclosed
US-10934261-B2 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2021-03-02 US disclosed
US-10934261-B2 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2021-03-02 US disclosed
US-10894776-B2 2021-01-19 US disclosed
US-10894776-B2 2021-01-19 US disclosed
EP-3189043-B1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR C4X DISCOVERY LTD (GB) 2020-11-18 EP disclosed
US-20080234233-A1 MEDICAMENT FOR TREATMENT OF NEURODEGENERATIVE DISEASES INSTITUTE OF MEDICINAL MOLECULAR DESIGN INC. (JP) 2008-09-25 US disclosed
US-20080234233-A1 MEDICAMENT FOR TREATMENT OF NEURODEGENERATIVE DISEASES INSTITUTE OF MEDICINAL MOLECULAR DESIGN INC. (JP) 2008-09-25 US disclosed
US-20080090779-A1 ANTIALLERGIC AGENTS INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2008-04-17 US disclosed
US-20080090779-A1 ANTIALLERGIC AGENTS INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2008-04-17 US disclosed
US-20070185059-A1 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-08-09 US disclosed
US-20070185059-A1 Antiallergic agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2007-08-09 US disclosed
WO-2006085815-A1 THIAZOLE DERIVATIVES, THEIR PROCESS FOR THEIR PREPARATION AND THEIR USE IN THERAPY ASTRAZENECA AB (SE) 2006-08-17 WO disclosed
US-20050014765-A1 Aryl-heteroaromatic products, compositions comprising them and use AVENTIS PHARMA S.A. (FR) 2005-01-20 US disclosed
CN-1153172-A Azole derivatives, their use, production and usage NIHON NOHYAKU CO LTD (JP) 1997-07-02 CN disclosed
EP-0761658-A1 Azole-phenyl urea derivatives as ACAT inhibitors and their production NIHON NOHYAKU CO., LTD. (JP) 1997-03-12 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 (9 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-10934261-B2 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 NTRK1 3553/4885CDC7 2949/4885DBF4 4356/4885
US-20050014765-A1 Aryl-heteroaromatic products, compositions comprising them and use AHR, ARNT, MYC NTRK1 1693/4885CDC7 1896/4885DBF4 1889/4885
US-10894776-B2 CAPNS1, CAPN9, CAPN2 NTRK1 4163/4885CDC7 2461/4885DBF4 4299/4885
US-20080090779-A1 ANTIALLERGIC AGENTS NAT1, EPX, HRH2 NTRK1 3836/4885CDC7 4721/4885DBF4 4331/4885
US-12024509-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor HCRTR1, HCRTR2, NPY1R NTRK1 895/4885CDC7 3825/4885DBF4 4722/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 NTRK1 3553/4885CDC7 2949/4885DBF4 4356/4885
US-20220324814-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF CAPNS1, CAPN9, CAPN1 NTRK1 3553/4885CDC7 2949/4885DBF4 4356/4885
US-20080234233-A1 MEDICAMENT FOR TREATMENT OF NEURODEGENERATIVE DISEASES MAPT, TFEB, MAOA NTRK1 2171/4885CDC7 4640/4885DBF4 4155/4885
US-20070185059-A1 Antiallergic agents NAT1, EPX, AHR NTRK1 3842/4885CDC7 4721/4885DBF4 4309/4885

“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.