SCHEMBL7711577

SCHEMBL7711577

CC(C)(C)Oc1cc[c]c(-c2ccc(Cl)cc2)c1-c1ccc(Cl)cc1

nearest known ligand 0.30

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 1/20 0.30
PPARA Q07869 1/20 0.30
TP53 P04637 1/20 0.30
MDM2 Q00987 1/20 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
SCHEMBL7705600 0.86 SENP1 (0.34) MEN1KMT2A
SCHEMBL7708620 0.84 PTGS2 (0.34) MAPTTP53
SCHEMBL7708151 0.83 CRHR1 (0.38) MEN1MAPTKMT2ATP53MDM2
SCHEMBL7702896 0.83 ALDH1A1 (0.32) MAPT
SCHEMBL7708795 0.80 ALDH1A1 (0.30)
SCHEMBL7711374 0.79 CA12 (0.44)
SCHEMBL11802233 0.78 CYP1A2 (0.41) MEN1CYP1A2KMT2A
SCHEMBL7707636 0.78 ABCB1 (0.32)
SCHEMBL7708308 0.78 CYP3A4 (0.36) CYP3A4MAPTKMT2A
SCHEMBL7708203 0.77 MEN1 (0.31) MEN1KMT2A

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-6358665-B1 ONIUM SALT PRECURSOR FOR GENERATING FLUOROALKYLSULFONATE CLARIANT INTERNATIONAL LTD. (CH) 2002-03-19 US disclosed
EP-1033624-A1 RADIATION-SENSITIVE COMPOSITION OF CHEMICAL AMPLIFICATION TYPE Clariant International Ltd. (CH) 2000-09-06 EP disclosed