SCHEMBL6554381

SCHEMBL6554381

[CH]C1CC(C)CC(C)(C)C1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL597801 0.80 ALDH1A1 (0.39) ALDH1A1LMNACYP3A4CYP1A2CYP2C9
SCHEMBL3783240 0.80 ALDH1A1 (0.39) ALDH1A1LMNACYP3A4CYP1A2CYP2C9
SCHEMBL598990 0.80 ALDH1A1 (0.39) ALDH1A1LMNACYP3A4CYP1A2CYP2C9
SCHEMBL3783239 0.80 ALDH1A1 (0.39) ALDH1A1LMNACYP3A4CYP1A2CYP2C9
SCHEMBL910279 0.73
SCHEMBL20381172 0.70 ALDH1A1 (0.35) ALDH1A1LMNACYP3A4CYP1A2CYP2C9
SCHEMBL24786145 0.68 ALDH1A1 (0.34) ALDH1A1LMNACYP3A4CYP1A2CYP2C9
SCHEMBL20993997 0.68 ALDH1A1 (0.34) ALDH1A1LMNACYP3A4CYP1A2CYP2C9
SCHEMBL931952 0.68 ALDH1A1 (0.34) ALDH1A1LMNACYP3A4CYP1A2CYP2C9
SCHEMBL1358694 0.68 APLNR (0.39) ALDH1A1LMNACYP3A4CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1003802-B1 METHOD FOR PREPARING (POLY)ISOCYANATE COMPOSITION WITH REDUCED VISCOSITY RHODIA CHIMIE SA (FR) 2004-12-22 EP claimed
EP-1466931-A2 Polyisocyanate composition Rhodia Chimie (FR) 2004-10-13 EP claimed
US-20040106762-A1 Method for the preparation of low-viscosity (poly) isocyanates RHODIA CHIMIE (FR) 2004-06-03 US claimed
JP-2002527555-A 2002-08-27 JP claimed
US-6288208-B1 POLYAMIDE DENDRIMERS; EPOXY HARDENERS EPOX, LTD. (IL) 2001-09-11 US claimed
EP-1121386-A1 HIGHLY BRANCHED OLIGOMERS, PROCESS FOR THEIR PREPARATION AND APPLICATIONS THEREOF Epox Ltd. (IL) 2001-08-08 EP claimed
EP-1003802-A1 METHOD FOR PREPARING (POLY)ISOCYANATE COMPOSITION WITH REDUCED VISCOSITY RHODIA CHIMIE (FR) 2000-05-31 EP claimed
WO-2000022030-A1 HIGHLY BRANCHED OLIGOMERS, PROCESS FOR THEIR PREPARATION AND APPLICATIONS THEREOF EPOX LTD. (IL) 2000-04-20 WO claimed
WO-1999007765-A1 METHOD FOR PREPARING (POLY)ISOCYANATE COMPOSITION WITH REDUCED VISCOSITY RHODIA CHIMIE (FR) 1999-02-18 WO claimed
US-6288208-B1 POLYAMIDE DENDRIMERS; EPOXY HARDENERS EPOX, LTD. (IL) 2001-09-11 US disclosed
EP-1121386-A1 HIGHLY BRANCHED OLIGOMERS, PROCESS FOR THEIR PREPARATION AND APPLICATIONS THEREOF Epox Ltd. (IL) 2001-08-08 EP disclosed
WO-2000022030-A1 HIGHLY BRANCHED OLIGOMERS, PROCESS FOR THEIR PREPARATION AND APPLICATIONS THEREOF EPOX LTD. (IL) 2000-04-20 WO disclosed