SCHEMBL7897653

SCHEMBL7897653

OC(CCC1CCCCC1)c1cccc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.48
CHRM3 P20309 1/20 0.48
EPHX2 P34913 3/20 0.44
EPHX1 P07099 2/20 0.42
ADRB3 P13945 2/20 0.42
SLC6A4 P31645 5/20 0.40
SLC6A2 P23975 4/20 0.40
SLC6A3 Q01959 1/20 0.40
METAP2 P50579 1/20 0.40
HTR2C P28335 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL1521003 0.81 KDM4E (0.49) CHRM3SLC6A4SLC6A2SLC6A3MEN1
SCHEMBL281883 0.76 IDO1 (0.48) ADRB3MEN1LMNAKMT2A
SCHEMBL282798 0.76 IDO1 (0.48) ADRB3MEN1LMNAKMT2A
SCHEMBL3156406 0.76 IDO1 (0.48) ADRB3MEN1LMNAKMT2A
SCHEMBL17073486 0.75 RIPK1 (0.39) CHRM1CHRM3EPHX1
SCHEMBL31067489 0.75 CPN1 (0.41) CHRM1CHRM3SLC6A4SLC6A2SLC6A3
SCHEMBL13232174 0.75 EPHX1 (0.47) EPHX2EPHX1NPC1LMNARAB9A
SCHEMBL17073423 0.75 CPN1 (0.41) CHRM1CHRM3SLC6A4SLC6A2SLC6A3
SCHEMBL31375638 0.74 OPRM1 (0.44) EPHX2EPHX1ADRB3SLC6A4SLC6A2
SCHEMBL26649090 0.74 OPRM1 (0.44) EPHX2EPHX1ADRB3SLC6A4SLC6A2

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-6204293-B1 INHIBITING POST-TRANSLATIONAL MODIFICATION OF THE ONCOGENIC RAS PROTEIN BY PROTEIN FARNESYLTRANSFERASE, PROTEIN GERANYLGERANYLTRANSFERASE, OR BOTH UNIVERSITY OF PITTSBURGH 2001-03-20 US disclosed