SCHEMBL8443181

SCHEMBL8443181

Nc1ccc2c(c1)c(O)nn2Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 5/20 0.47
CNR1 P21554 1/20 0.46
ACHE P22303 1/20 0.46
CNR2 P34972 1/20 0.46
TDP1 Q9NUW8 1/20 0.41
KMT2A Q03164 1/20 0.40
SRC P12931 1/20 0.40
PRKACA P17612 1/20 0.40
PRKACG P22612 1/20 0.40
PRKACB P22694 1/20 0.40
CYP3A4 P08684 2/20 0.39
TSHR P16473 1/20 0.39
MCL1 Q07820 1/20 0.38
ABCB11 O95342 3/20 0.38
CYP2C9 P11712 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPT P10636 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
SCHEMBL8522550 0.88 CNR1 (0.49) CNR1ACHECNR2TDP1KMT2A
SCHEMBL8307879 0.86 ABCB11 (0.47) CCR2TDP1KMT2ASRCPRKACA
SCHEMBL6977416 0.81 SRC (0.38) CCR2TDP1SRCPRKACAPRKACG
SCHEMBL8310022 0.81 CCR2 (0.50) CCR2CNR1CNR2KMT2ACYP3A4
SCHEMBL8627064 0.78 EPHX1 (0.50) KMT2APRKACAMCL1LMNAMAPT
SCHEMBL8445913 0.78 CYP1A2 (0.52) CNR1ACHECNR2CYP3A4TSHR
SCHEMBL8629884 0.76 EPHX1 (0.52) CCR2CNR1KMT2APRKACAMCL1
SCHEMBL8446930 0.73 MCL1 (0.42) CNR1ACHECNR2TDP1KMT2A
SCHEMBL8626596 0.72 MEN1 (0.54) CNR1TDP1KMT2AALDH1A1LMNA
SCHEMBL8626573 0.72 RAF1 (0.49) CCR2KMT2ASRCALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5776932-A ANTIALLERGENS, ANTIASTHMATICS, ANTIINFLAMMATORY AGENTS AND MODULATORS ARZNEIMITTELWERK DRESDEN G.M.B.H. (DE) 1998-07-07 US claimed
EP-0888307-A1 1,3,5-TRISUBSTITUTED INDAZOLE DERIVATIVES WITH AN ANTI-ASTHMATIC, ANTI-ALLERGIC, ANTI-INFLAMMATORY AND IMMUNOMODULATING ACTION ARZNEIMITTELWERK DRESDEN GMBH (DE) 1999-01-07 EP disclosed
US-5776932-A ANTIALLERGENS, ANTIASTHMATICS, ANTIINFLAMMATORY AGENTS AND MODULATORS ARZNEIMITTELWERK DRESDEN G.M.B.H. (DE) 1998-07-07 US disclosed
WO-1997034874-A1 1,3,5-TRISUBSTITUTED INDAZOLE DERIVATIVES WITH AN ANTI-ASTHMATIC, ANTI-ALLERGIC, ANTI-INFLAMMATORY AND IMMUNOMODULATING ACTION ARZNEIMITTELWERK DRESDEN GMBH (DE) 1997-09-25 WO disclosed