SCHEMBL167549

SCHEMBL167549

NC(=O)Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.89

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 6/20 0.89
EPHX2 P34913 1/20 0.70
ALDH1A1 P00352 1/20 0.61
PTGS1 P23219 3/20 0.61
TGM2 P21980 1/20 0.59
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
PEPD P12955 1/20 0.57
CA12 O43570 1/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
MAPT P10636 1/20 0.57
CA9 Q16790 1/20 0.57
TRPV1 Q8NER1 2/20 0.56

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
SCHEMBL5427711 0.94 KIF11 (1.00) KIF11EPHX2ALDH1A1PTGS1
SCHEMBL30772270 0.87 KIF11 (0.70) KIF11EPHX2ALDH1A1PTGS1TGM2
SCHEMBL29145261 0.84 KIF11 (0.66) KIF11EPHX2PTGS1TGM2NPC1
SCHEMBL28233684 0.84 KIF11 (0.66) KIF11EPHX2ALDH1A1NPC1PEPD
SCHEMBL28729179 0.83 EPHX2 (1.00) KIF11EPHX2TGM2NPC1RAB9A
SCHEMBL11003408 0.83 EPHX2 (1.00) KIF11EPHX2TGM2NPC1RAB9A
SCHEMBL2518624 0.83 EPHX2 (0.76) KIF11EPHX2ALDH1A1PTGS1TGM2
SCHEMBL11626027 0.82 SMN1; SMN2 (0.69) KIF11EPHX2ALDH1A1NPC1PEPD
SCHEMBL4099319 0.82 KIF11 (0.63) KIF11EPHX2ALDH1A1PTGS1TGM2
SCHEMBL5062623 0.82 PEPD (0.80) KIF11ALDH1A1NPC1RAB9APEPD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022036063-A2 COMPOSITIONS AND METHODS FOR TREATING PROLIFERATIVE DISEASES THE BROAD INSTITUTE, INC. (US) 2022-02-17 WO claimed
CN-111988996-A Increasing yield of nut bearing plants UPL有限责任公司 2020-11-24 CN claimed
US-20190254281-A1 ENHANCED YIELD IN NUT BEARING PLANTS UPL CORPORATION LTD. (MU) 2019-08-22 US claimed
WO-2019161274-A1 ENHANCED YIELD IN NUT BEARING PLANTS UPL CORPORATION LTD. (MU) 2019-08-22 WO claimed
CN-109476637-A heterocyclic Prolinamide derivatives 奥瑞恩眼科有限责任公司 2019-03-15 CN claimed
CN-106496116-A Quinolines containing double aryl urea structures and application thereof 沈阳药科大学 2017-03-15 CN claimed
CN-103221388-A Novel sulfonamide compounds for inhibition of metastatic tumor growth METASIGNAL THERAPEUTICS INC 2013-07-24 CN claimed
EP-2611806-A1 DEUTERIUM-ENRICHED HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS Ascepion Pharmaceuticals, Inc. (CN) 2013-07-10 EP claimed
WO-2012028106-A1 DEUTERIUM-ENRICHED HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS ASCEPION PHARMACEUTICALS, INC. (CN) 2012-03-08 WO claimed
EP-1891072-A2 SUBSTITUTED 7, 8-DIHYDRO-1H-PYRIMIDO[4,5-B][1,4] DIAZEPIN-4-AMINES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2008-02-27 EP claimed
WO-2006124813-A2 SUBSTITUTED 7, 8-DIHYDRO-1H-PYRIMIDO [4,5-B] [1,4] DIAZEPIN-4-AMINES AS?KINASE INHIBITORS ABBOTT LABORATORIES (US) 2006-11-23 WO claimed
CN-1492762-A Azoles as malonyl-COA decarboxylase inhibitors useful as metabolic modulators ������ҩ��ʽ���� 2004-04-28 CN claimed
EP-1370260-A2 AZOLES AS MALONYL-COA DECARBOXYLASE INHIBITORS USEFUL AS METABOLIC MODULATORS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-12-17 EP claimed
WO-2002068586-A2 HIV/FIV PROTEASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2002-09-06 WO claimed
WO-2002066035-A2 AZOLES AS MALONYL-COA DECARBOXYLASE INHIBITORS USEFUL AS METABOLIC MODULATORS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-08-29 WO claimed
WO-2001064036-A1 ENHANCEMENT OF SEED/FRUIT/NUT YIELDS FROM FLOWERING PLANTS UNIROYAL CHEMICAL COMPANY, INC. (US) 2001-09-07 WO claimed
US-6242385-B1 SEEDS OF LEGUME PLANTS, APPLYING TO FOLAGE DURING REPRODUCTION PHENYLUREA DERIVATIVES UNIROYAL CHEMICAL COMPANY, INC. 2001-06-05 US claimed
EP-1005459-A1 SUBSTITUTED ISOQUINOLINES AS ANTICONVULSIVANTS SMITHKLINE BEECHAM PLC (GB) 2000-06-07 EP claimed
WO-1999014197-A1 SUBSTITUTED ISOQUINOLINES AS ANTICONVULSIVANTS SMITHKLINE BEECHAM PLC (GB) 1999-03-25 WO claimed
US-4250319-A RIPENER FOR SUGARCANE W. R. GRACE & CO. (US) 1981-02-10 US claimed

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

For each of this compound's patents that has machine-readable text (1 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-20190254281-A1 ENHANCED YIELD IN NUT BEARING PLANTS NUTF2, MYCBP, MYCBP2 KIF11 2646/4885EPHX2 1807/4885ALDH1A1 3840/4885

“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.