SCHEMBL11147137

SCHEMBL11147137

C=Cc1cccc(C)c1CCCCC

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.39
CXCR5 P32302 1/20 0.39
GPR84 Q9NQS5 1/20 0.38
THRB P10828 6/20 0.36
THRA P10827 5/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TLR8 Q9NR97 1/20 0.35
CNR1 P21554 2/20 0.35
LPL P06858 1/20 0.33
LIPG Q9Y5X9 1/20 0.33
TSHR P16473 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
SCHEMBL17160000 0.98 KCNH2 (0.42) KCNH2CXCR5GPR84THRBTHRA
SCHEMBL9312403 0.98 KCNH2 (0.42) KCNH2CXCR5GPR84THRBTHRA
SCHEMBL17160026 0.98 KCNH2 (0.42) KCNH2CXCR5GPR84THRBTHRA
SCHEMBL7944721 0.95 TSHR (0.34) KCNH2CXCR5GPR84THRBTHRA
SCHEMBL9310858 0.89 TSHR (0.38) CXCR5THRBTSHR
SCHEMBL10534629 0.89 KCNH2 (0.46) KCNH2GPR84THRBTHRAMEN1
SCHEMBL10532769 0.89 KCNH2 (0.46) KCNH2GPR84THRBTHRAMEN1
SCHEMBL5078058 0.89 KCNH2 (0.46) KCNH2GPR84THRBTHRAMEN1
SCHEMBL10426036 0.85 THRA (0.37) KCNH2GPR84THRBTHRAMEN1
SCHEMBL18568266 0.84 THRA (0.42) KCNH2GPR84THRBTHRALIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4391894-A BASIC DYE REACTED WITH ORGANIC ACID DISSOLVED IN A PHOTOSENSITIVE DIAZO COMPOSITION POLYCHROME CORPORATION (US) 1983-07-05 US disclosed
US-4347300-A CONCURRENT PRODUCTION OF NEGATIVE AND POSITIVE IMAGE; DIAZOTIXZATION; LITHOGRAPHY POLYCHROME CORPORATION (US) 1982-08-31 US disclosed