SCHEMBL27451664

SCHEMBL27451664

CON=C(C(=O)OC)c1cccnc1-c1ccc(C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.43
HIF1A Q16665 7/20 0.42
KDM4E B2RXH2 3/20 0.39
HPGD P15428 3/20 0.39
ALDH1A1 P00352 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ATM Q13315 1/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
MAPT P10636 1/20 0.39
AHR P35869 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SYK P43405 1/20 0.38
AURKB Q96GD4 1/20 0.38
INCENP Q9NQS7 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
SCHEMBL8024933 0.81 P2RX7 (0.50) HIF1AKDM4EALDH1A1KMT2ANPC1
SCHEMBL14564455 0.79 TRPV1 (0.50) TRPV1KDM4EHPGDALDH1A1KMT2A
SCHEMBL27449778 0.77 LMNA (0.50) HIF1ACYP1A2CYP2C9CYP2C19NPC1
SCHEMBL9002411 0.76 TRPV1 (0.51) TRPV1KDM4EHPGDALDH1A1KMT2A
SCHEMBL8025024 0.75 HIF1A (0.47) HIF1AKDM4EHPGDALDH1A1NPC1
SCHEMBL14564497 0.74 KDM4E (0.67) TRPV1KDM4EALDH1A1KMT2ANPC1
SCHEMBL27449779 0.74 ADRB2 (0.37) HIF1AKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL28206097 0.73 SMN1; SMN2 (0.57) TRPV1KDM4EHPGDALDH1A1KMT2A
SCHEMBL20313136 0.71 TSHR (0.53) KDM4EHPGDALDH1A1KMT2AMEN1
SCHEMBL29915881 0.71 TRPV1 (0.45) TRPV1KDM4EHPGDALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1133036-A 2-oximino-2-pyridyl acetic acid derivatives as anti-parasitic agents (fungicides) BAYER AG (DE) 1996-10-09 CN disclosed