SCHEMBL27715739

SCHEMBL27715739

CCCCCCCCCCCCCCCCC(C)(N)N

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.48
FDPS P14324 2/20 0.48
TSHR P16473 2/20 0.47
THRB P10828 1/20 0.47
DNM1 Q05193 8/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.43
EPHX1 P07099 1/20 0.43
GGPS1 O95749 1/20 0.41

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
SCHEMBL26622 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL2202284 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL15993989 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL11523108 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL11519357 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL15993844 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL700132 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL2150981 0.97
SCHEMBL372341 0.88
SCHEMBL9061488 0.87 SMPD1 (0.33) SMPD1FDPS

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
CN-101299135-B Electronic photographic photoreceptor, processing cassette and image forming device FUJI XEROX CO LTD 2012-07-18 CN disclosed
CN-101039987-A Polyimide resin composition, liquid crystal alignment film using same and liquid crystal display using such liquid crystal alignment film HITACHI CABLE (JP) 2007-09-19 CN disclosed