SCHEMBL8524430

SCHEMBL8524430

[Cr].c1ccc(-c2ccon2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 1/20 0.50
RAB9A P51151 6/20 0.49
NPC1 O15118 5/20 0.49
KDM4E B2RXH2 3/20 0.49
MAPT P10636 1/20 0.49
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP19A1 P11511 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
NOTUM Q6P988 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 2/20 0.38
LMNA P02545 1/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL139209 0.98 MDM2 (0.51) MDM2RAB9ANPC1KDM4EMAPT
SCHEMBL2409954 0.93 MDM2 (0.49) MDM2RAB9ANPC1KDM4EMAPT
SCHEMBL27913095 0.91 MDM2 (0.47) MDM2RAB9ANPC1KDM4EMAPT
SCHEMBL16175776 0.86 MDM2 (0.44) MDM2RAB9ANPC1KDM4EMAPT
Carbamic Acid SCHEMBL29154176 0.86 MDM2 (0.44) MDM2RAB9ANPC1KDM4EMAPT
SCHEMBL4059081 0.85 CYP1A2 (0.57) MDM2RAB9ANPC1KDM4EMAPT
Tetrahydrofuran SCHEMBL27422789 0.84 MDM2 (0.43) MDM2RAB9ANPC1KDM4EMAPT
SCHEMBL27402049 0.83 MDM2 (0.45) MDM2RAB9ANPC1KDM4EMAPT
Oxazole SCHEMBL27278480 0.81 RAB9A (0.43) MDM2RAB9ANPC1KDM4EMAPT
Oxazolidine SCHEMBL27610765 0.81 MDM2 (0.41) MDM2RAB9ANPC1KDM4EMAPT

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
US-5952359-A NEMATICIDES, INSECTICIDES AND MITICIDES; 1,1-DIFLUORO-3-(THIAZOLYL OR ISOTHIAZOYL-THIO (OR SULFINYL OR SULFONYL)-PROP-1-ENE DERIVATIVES ZENECA LIMITED (GB) 1999-09-14 US disclosed