SCHEMBL8664022

SCHEMBL8664022

c1ccc2c(c1)CC1=C(CCCC1)C2

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.58
CYP1A2 P05177 1/20 0.46
CYP2A6 P11509 2/20 0.44
HTR2C P28335 1/20 0.43
DRD2 P14416 3/20 0.42
DRD1 P21728 3/20 0.42
DRD4 P21917 2/20 0.42
DRD5 P21918 2/20 0.42
DRD3 P35462 2/20 0.42
HPGD P15428 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
BCL2L1 Q07817 1/20 0.36
BAD Q92934 1/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ANPEP P15144 1/20 0.35
CES1 P23141 1/20 0.35

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
SCHEMBL28666289 0.97 TSHR (0.55) TSHRCYP1A2CYP2A6HTR2CDRD2
SCHEMBL8664624 0.95 TSHR (0.52) TSHRCYP1A2CYP2A6HTR2CDRD2
SCHEMBL9710344 0.94 TSHR (0.50) TSHRCYP1A2CYP2A6HTR2CDRD2
SCHEMBL8666004 0.81 CYP1A2 (0.56) TSHRCYP1A2CYP2A6HTR2CDRD2
SCHEMBL202264 0.76 TSHR (0.44) TSHRCYP2A6DRD1DRD3HPGD
Potassium SCHEMBL7551769 0.74 SIGMAR1 (0.43) TSHRCYP2A6DRD1DRD3HPGD
Lithium SCHEMBL7545662 0.74 SIGMAR1 (0.43) TSHRCYP2A6DRD1DRD3HPGD
Methane SCHEMBL5909544 0.74 SIGMAR1 (0.43) TSHRCYP2A6DRD1DRD3HPGD
SCHEMBL4652407 0.74 TSHR (0.37) TSHRCYP1A2CYP2A6DRD2DRD1
SCHEMBL11645158 0.74 TSHR (1.00) TSHRCYP2A6HTR2CDRD2DRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5808154-A Process for the production of an aromatic hydrazo compound TOYO INK MANUFACTURING CO., LTD. (JP) 1998-09-15 US disclosed
EP-0391606-B1 Process for the production of an aromatic hydrazo compound TOYO INK MFG CO (JP) 1995-07-05 EP disclosed
EP-0391606-A1 Process for the production of an aromatic hydrazo compound TOYO INK MANUFACTURING CO., LTD. (JP) 1990-10-10 EP disclosed