SCHEMBL10104417

SCHEMBL10104417

Cc1ccccc1-c1noc(=O)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.47
FTO Q9C0B1 1/20 0.46
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
DCUN1D1 Q96GG9 2/20 0.42
DHODH Q02127 1/20 0.40
LTB4R2 Q9NPC1 1/20 0.40
RARB P10826 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
KCNA3 P22001 1/20 0.38
SLC9A1 P19634 1/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL31546405 1.00 NOTUM (0.47) NOTUMFTONPC1RAB9ASMN1; SMN2
SCHEMBL603096 0.81 KMO (0.40) NOTUMFTONPC1RAB9ASMN1; SMN2
SCHEMBL2773609 0.80 LTB4R2 (0.50) FTOALDH1A1DHODHLTB4R2
SCHEMBL27362952 0.80 ALDH1A1 (0.44) FTOALDH1A1HPGDNPSR1DHODH
SCHEMBL2645837 0.80 ALDH1A1 (0.44) FTOALDH1A1HPGDNPSR1DHODH
SCHEMBL1935315 0.79 TGFBR1 (0.44) NOTUMFTONPC1RAB9ASMN1; SMN2
SCHEMBL31546406 0.79 FTO (0.49) NOTUMFTONPC1RAB9ASMN1; SMN2
SCHEMBL21634961 0.79 ALDH1A1 (0.42) FTONPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL21034046 0.79 LTB4R2 (0.51) FTOALDH1A1LTB4R2
SCHEMBL2645840 0.79 KDM4E (0.47) FTONPC1RAB9AALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9315493-B2 Phenylpyridine derivative and drug containing same KOWA COMPANY, LTD. (JP) 2016-04-19 US disclosed
US-8778954-B2 Phenylpyridine derivative and medicinal agent comprising same KOWA COMPANY, LTD. (JP) 2014-07-15 US disclosed
US-20140011823-A1 NOVEL PHENYLPYRIDINE DERIVATIVE AND DRUG CONTAINING SAME KOWA COMPANY, LTD. (JP) 2014-01-09 US disclosed
US-20120165353-A1 NOVEL PHENYLPYRIDINE DERIVATIVE AND MEDICINAL AGENT COMPRISING SAME KOWA COMPANY, LTD. (JP) 2012-06-28 US disclosed
US-20090203667-A1 PENTADIENAMIDE DERIVATIVES KYOWA HAKKO KIRIN CO., LTD. (JP) 2009-08-13 US disclosed
US-20090203667-A1 PENTADIENAMIDE DERIVATIVES KYOWA HAKKO KIRIN CO., LTD. (JP) 2009-08-13 US disclosed
EP-2050734-A1 PENTADIENAMIDE DERIVATIVE Kyowa Hakko Kirin Co., Ltd. (JP) 2009-04-22 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 (3 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-20090203667-A1 PENTADIENAMIDE DERIVATIVES PRMT1, REN, NGLY1 NOTUM 630/4885FTO 1593/4885NPC1 3999/4885
US-20140011823-A1 NOVEL PHENYLPYRIDINE DERIVATIVE AND DRUG CONTAINING SAME AGTR2, AGTR1, PPARD NOTUM 2960/4885FTO 4519/4885NPC1 2133/4885
US-20120165353-A1 NOVEL PHENYLPYRIDINE DERIVATIVE AND MEDICINAL AGENT COMPRISING SAME AGTR2, AGTR1, PPARD NOTUM 436/4885FTO 4663/4885NPC1 2655/4885

“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.