SCHEMBL165772

SCHEMBL165772

CC(C)Cc1cc[c]c(C(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
POLB P06746 2/20 0.32
MAPT P10636 2/20 0.32
PTGS2 P35354 4/20 0.32
PTGS1 P23219 3/20 0.32
LMNA P02545 3/20 0.32
CYP2C9 P11712 3/20 0.32
HTR2A P28223 3/20 0.32
ESR1 P03372 3/20 0.32
AKR1C3 P42330 2/20 0.32
CXCR1 P25024 2/20 0.32
CXCR2 P25025 2/20 0.32
ALOX5 P09917 2/20 0.32
NFKB1 P19838 2/20 0.32
HTR2B P41595 2/20 0.32
BLM P54132 2/20 0.32
PMP22 Q01453 2/20 0.32

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
SCHEMBL11442367 0.82 ESR1 (0.34) ESR1
SCHEMBL1777142 0.82 CYP1A2 (0.38) MAPTLMNAAKR1C3AKR1C2ALDH1A1
SCHEMBL27730438 0.80 CSNK2A1 (0.36) NFKB1ALDH1A1CYP3A4
SCHEMBL15067851 0.79 GABRA1 (0.42) GABRA1GABRB2MEN1KMT2APOLB
SCHEMBL1776652 0.78 CNR1 (0.37) ALOX5CNR1
SCHEMBL677764 0.78 GABRA1 (0.41) GABRA1GABRB2MEN1KMT2APOLB
SCHEMBL7469143 0.78 GABRA1 (0.41) GABRA1GABRB2MEN1KMT2APOLB
SCHEMBL921395 0.76 GABRA1 (0.40) GABRA1GABRB2MEN1KMT2APOLB
SCHEMBL6299128 0.76 GABRA1 (0.40) GABRA1GABRB2MEN1KMT2APOLB
SCHEMBL27370589 0.76 GABRA1 (0.40) GABRA1GABRB2MEN1KMT2APOLB

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-2424913-A1 CASTABLE POLYUREA COMPOSITIONS FOR GOLF BALL COVERS Dow Global Technologies LLC (US) 2012-03-07 EP disclosed
WO-2010126931-A1 CASTABLE POLYUREA COMPOSITIONS FOR GOLF BALL COVERS DOW GLOBAL TECHNOLOGIES INC. (US) 2010-11-04 WO disclosed