SCHEMBL31481925

SCHEMBL31481925

O=C(O)C(=O)NCc1ncc(Br)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 1/20 0.38
PLAU P00749 1/20 0.36
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAPK10 P53779 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 2/20 0.33
TSHR P16473 1/20 0.33
P2RX7 Q99572 1/20 0.33
GLA P06280 1/20 0.33

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
SCHEMBL16793840 0.88 NPC1 (0.39) PLAUKMT2AMEN1NPC1RAB9A
SCHEMBL29277569 0.84 TSHR (0.36) GPR35PLAUKMT2AMEN1NPC1
SCHEMBL30713271 0.84 TSHR (0.36) GPR35PLAUKMT2AMEN1NPC1
SCHEMBL30357636 0.81 GPR35 (0.49) GPR35NPC1RAB9ACYP1A2CYP3A4
SCHEMBL27389799 0.81 GPR35 (0.49) GPR35NPC1RAB9ACYP1A2CYP3A4
SCHEMBL30162902 0.76 AAK1 (0.45) KDM4EPOLB
SCHEMBL16809853 0.76 AAK1 (0.45) KDM4EPOLB
SCHEMBL16540928 0.76 GLA (0.40) PLAUKMT2AMEN1NPC1RAB9A
SCHEMBL27956166 0.76 AGBL2 (0.44) PLAUKMT2AMEN1CYP1A2CYP3A4
SCHEMBL14331014 0.75 PLAU (0.40) PLAUKMT2AMEN1NPC1RAB9A

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
WO-2025035108-A2 INHIBITORS OF PARG ARASE THERAPEUTICS INC. (US) 2025-02-13 WO disclosed