SCHEMBL8465270

SCHEMBL8465270

CCC(CC)(C1CC(=O)O1)P(=O)(O)O

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.38
PRKCA P17252 1/20 0.32
FDPS P14324 12/20 0.31
GGPS1 O95749 7/20 0.31
PPARG P37231 1/20 0.30
CYP1A2 P05177 2/20 0.30

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
SCHEMBL1115349 0.71 SMN1; SMN2 (0.41) SMN1; SMN2PRKCACYP1A2
SCHEMBL21925054 0.70 FDPS (0.34) FDPSGGPS1
SCHEMBL11213638 0.69 FDPS (0.31) FDPS
SCHEMBL11221540 0.67
SCHEMBL8352516 0.66
SCHEMBL22653299 0.66
SCHEMBL11178390 0.65 SMN1; SMN2 (0.39) SMN1; SMN2PPARGCYP1A2
SCHEMBL22653289 0.65
SCHEMBL7449443 0.63
SCHEMBL973001 0.63 FDPS (0.33) FDPSGGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5977330-A AS HUMECTANTS FOR SKIN AND MUCOUS MEMBRANES; ANTIDEPOSIT AGENTS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-11-02 US disclosed
US-5708152-A DERIVATIVES AS HUMECTANTS AND ANTIDEPOSIT AGENTS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-01-13 US disclosed
EP-0563013-B1 N-substituted chitosane derivatives, process for preparing them and their use CIBA GEIGY AG (CH) 1997-04-23 EP disclosed
EP-0563013-A2 N-substituted chitosane derivatives, process for preparing them and their use CIBA-GEIGY AG (CH) 1993-09-29 EP disclosed