SCHEMBL7370559

SCHEMBL7370559

Cc1cc(NC(=O)Cc2cc(C(=N)NO)ccc2OCc2ccccc2)ccc1C(=O)N1CCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 2/20 0.41
P2RX4 Q99571 1/20 0.41
HPGD P15428 3/20 0.40
MAPT P10636 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
ALDH1A1 P00352 1/20 0.40
ATM Q13315 1/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC2 Q92769 1/20 0.40
HSD17B10 Q99714 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
AVPR2 P30518 1/20 0.39
PTGER1 P34995 1/20 0.38
F10 P00742 2/20 0.38
PRSS1 P07477 2/20 0.38
KMT2A Q03164 1/20 0.38
SMPD1 P17405 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
SCHEMBL5094227 0.91 MET (0.41) METP2RX4HPGDMAPTNPC1
Hydrochloric Acid SCHEMBL5093183 0.90 F10 (0.47) METP2RX4NPC1RAB9AF10
SCHEMBL5094411 0.87 HSD11B1 (0.44) HPGDMAPTNPC1RAB9AHSD17B10
SCHEMBL7160217 0.86 P2RX4 (0.44) METP2RX4HPGDMAPTNPC1
SCHEMBL6554470 0.85 SMPD1 (0.43) HPGDMAPTNPC1RAB9AALDH1A1
SCHEMBL5099764 0.85 MET (0.46) METP2RX4NPC1RAB9AALDH1A1
SCHEMBL7123492 0.83 MET (0.36) METP2RX4HDAC1HDAC2POLB
SCHEMBL5091382 0.83 F10 (0.43) METHPGDNPC1RAB9AALDH1A1
SCHEMBL5089072 0.82 HSD17B10 (0.38) HPGDMAPTNPC1RAB9AALDH1A1
SCHEMBL5089081 0.82 SMN1; SMN2 (0.40) METHPGDMAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1206446-A1 CARBOXYLIC ACID AMIDES, THEIR PRODUCTION AND THEIR USE AS DRUGS Boehringer Ingelheim Pharma KG (DE) 2002-05-22 EP disclosed
WO-2001010823-A1 CARBOXYLIC ACID AMIDES, THEIR PRODUCTION AND THEIR USE AS DRUGS BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-02-15 WO disclosed