SCHEMBL10347705

SCHEMBL10347705

CCCCCCCC1CCC(c2ccc(CCc3ccc(N=C=S)cc3)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SPHK1 Q9NYA1 13/20 0.49
▸ P2RY6 Q15077 1/20 0.48
▸ SPHK2 Q9NRA0 7/20 0.44
▸ MEN1 O00255 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CYP2C9 P11712 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL1274451 1.00 SPHK1 (0.49) SPHK1P2RY6SPHK2MEN1MAPK1
SCHEMBL10347886 1.00 SPHK1 (0.49) SPHK1P2RY6SPHK2MEN1MAPK1
SCHEMBL10347704 1.00 SPHK1 (0.49) SPHK1P2RY6SPHK2MEN1MAPK1
SCHEMBL9347184 1.00 SPHK1 (0.49) SPHK1P2RY6SPHK2MEN1MAPK1
SCHEMBL10477201 1.00 SPHK1 (0.49) SPHK1P2RY6SPHK2MEN1MAPK1
SCHEMBL10347887 1.00 SPHK1 (0.49) SPHK1P2RY6SPHK2MEN1MAPK1
SCHEMBL10477203 1.00 SPHK1 (0.49) SPHK1P2RY6SPHK2MEN1MAPK1
SCHEMBL10348259 0.99 P2RY6 (0.49) SPHK1P2RY6SPHK2MEN1MAPK1
SCHEMBL10348260 0.99 P2RY6 (0.49) SPHK1P2RY6SPHK2MEN1MAPK1
SCHEMBL20893309 0.96 SPHK1 (0.48) SPHK1P2RY6SPHK2MEN1MAPK1

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
EP-0227004-B1 LIQUID CRYSTALLINE ETHANE DERIVATIVES, THEIR PREPARATION AND THE LIQUID CRYSTAL COMPOSITIONS CONTAINING SAME Wojskowa Akademia Techniczna im. Jaroslawa Dabrowskiego (PL) 1990-04-11 — — EP disclosed
US-4849130-A ISOTHIOCYANATES WOJSKOWA AKADEMIA TECHNICZNA (PL) 1989-07-18 — — US disclosed
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