SCHEMBL913895

SCHEMBL913895

Cc1ccc2nc(-c3ccccc3)oc(=O)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.70
RAB9A P51151 4/20 0.70
C1R P00736 1/20 0.68
ELANE P08246 4/20 0.66
KDM4E B2RXH2 6/20 0.64
ALDH1A1 P00352 6/20 0.64
POLB P06746 2/20 0.62
KMT2A Q03164 2/20 0.62
MEN1 O00255 1/20 0.62
PTK2B Q14289 1/20 0.62
HPGD P15428 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
CASP3 P42574 1/20 0.60
SENP8 Q96LD8 1/20 0.60
SENP7 Q9BQF6 1/20 0.60
SENP6 Q9GZR1 1/20 0.60
RXFP1 Q9HBX9 1/20 0.54
MAPT P10636 2/20 0.54
LMNA P02545 1/20 0.54
F2 P00734 2/20 0.53

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
SCHEMBL2333007 0.94 RAB9A (0.69) NPC1RAB9AC1RELANEKDM4E
SCHEMBL914389 0.91 ALDH1A1 (0.61) NPC1RAB9AC1RELANEKDM4E
SCHEMBL12744508 0.89 NPC1 (0.73) NPC1RAB9AC1RELANEKDM4E
SCHEMBL914149 0.87 RAB9A (0.61) NPC1RAB9AC1RELANEKDM4E
SCHEMBL6567424 0.86 ELANE (0.62) NPC1RAB9AC1RELANEKDM4E
SCHEMBL914708 0.86 KDM4E (0.56) NPC1RAB9AC1RELANEKDM4E
SCHEMBL10780103 0.85 ELANE (0.77) NPC1RAB9AC1RELANEKDM4E
SCHEMBL10781834 0.83 ELANE (0.74) NPC1RAB9AC1RELANEKDM4E
SCHEMBL13137740 0.83 HPN (0.54) NPC1RAB9AC1RELANEKDM4E
SCHEMBL914482 0.83 NPC1 (1.00) NPC1RAB9AELANEKDM4EALDH1A1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10993938-B2 Lactam compound, preparation method and use thereof OCEAN UNIVERSITY OF CHINA (CN) 2021-05-04 US disclosed
US-20210033886-A1 LENS FOR SPECTACLES AND SPECTACLES FUJIFILM CORPORATION (JP) 2021-02-04 US disclosed
US-20200030312-A1 Lactam Compound, Preparation Method and Use thereof OCEAN UNIVERSITY OF CHINA (CN) 2020-01-30 US disclosed
US-8304538-B2 Method of producing benzoxazinone-based compound FUJIFILM CORPORATION (JP) 2012-11-06 US disclosed
US-8304538-B2 Method of producing benzoxazinone-based compound FUJIFILM CORPORATION (JP) 2012-11-06 US disclosed
US-20110015314-A1 ULTRAVIOLET ABSORBENT AND PRODUCTION METHOD OF THE SAME FUJIFILM CORPORATION (JP) 2011-01-20 US disclosed
US-20110015314-A1 ULTRAVIOLET ABSORBENT AND PRODUCTION METHOD OF THE SAME FUJIFILM CORPORATION (JP) 2011-01-20 US disclosed
US-7872052-B2 Use of heterocyclic compounds as SCCE inhibitors AREXIS AB (SE) 2011-01-18 US disclosed
US-20100256362-A1 METHOD OF PRODUCING BENZOXAZINONE-BASED COMPOUND FUJIFILM CORPORATION (JP) 2010-10-07 US disclosed
US-20100256362-A1 METHOD OF PRODUCING BENZOXAZINONE-BASED COMPOUND FUJIFILM CORPORATION (JP) 2010-10-07 US disclosed
WO-2009041715-A1 METHOD OF PRODUCING BENZOXAZINONE-BASED COMPOUND FUJIFILM CORPORATION (JP) 2009-04-02 WO disclosed
US-20060258651-A1 Use of heterocyclic compounds as scce inhibitors QUANTUM LTO HOLDINGS, LLC 2006-11-16 US disclosed
EP-1631295-A2 USE OF FUSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN CONDITIONS OR CANCER Arexis AB (SE) 2006-03-08 EP disclosed
WO-2004108139-A2 USE OF FUSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN CONDITIONS OR CANCER AREXIS AB (SE) 2004-12-16 WO 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 (5 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-20060258651-A1 Use of heterocyclic compounds as scce inhibitors RCE1, CTSE, SPINT2 NPC1 4151/4885RAB9A 3514/4885C1R 202/4885
US-20200030312-A1 Lactam Compound, Preparation Method and Use thereof FURIN, PEPD, PIN1 NPC1 810/4885RAB9A 1387/4885C1R 1184/4885
US-10993938-B2 Lactam compound, preparation method and use thereof FURIN, PEPD, PIN1 NPC1 810/4885RAB9A 1387/4885C1R 1184/4885
US-20110015314-A1 ULTRAVIOLET ABSORBENT AND PRODUCTION METHOD OF THE SAME SLC40A1, F2, SLC19A1 NPC1 491/4885RAB9A 1212/4885C1R 73/4885
US-20100256362-A1 METHOD OF PRODUCING BENZOXAZINONE-BASED COMPOUND SDHA, CYP4X1, SDHB NPC1 2972/4885RAB9A 1686/4885C1R 523/4885

“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.