SCHEMBL8578403

SCHEMBL8578403

CCc1ccc(C(C)CC(c2ccc(CC)cc2C)c2ccc(CC)cc2C)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ AKR1C3 P42330 1/20 0.35
▸ AKR1C2 P52895 1/20 0.35
▸ TRPA1 O75762 1/20 0.34
▸ PDE2A O00408 1/20 0.34
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2A6 P11509 1/20 0.33
▸ RAPGEF4 Q8WZA2 1/20 0.33
▸ TP53 P04637 1/20 0.31
▸ ALOX5 P09917 1/20 0.31
▸ PTGS1 P23219 1/20 0.31
▸ PTGS2 P35354 1/20 0.31
▸ KDM4E B2RXH2 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
SCHEMBL11449778 0.79 CYP1A2 (0.43) MAPTALDH1A1LMNANPC1MAPK1
SCHEMBL12250615 0.77 TRPA1 (0.43) MAPTALDH1A1LMNANPC1MAPK1
SCHEMBL8777756 0.76 ESR2 (0.44) ESR1ESR2
SCHEMBL19122843 0.76 TRPA1 (0.38) MAPTALDH1A1LMNANPC1MAPK1
SCHEMBL9167871 0.76 TRPA1 (0.38) MAPTALDH1A1LMNANPC1MAPK1
SCHEMBL18266512 0.76 LMNA (0.38) MAPTALDH1A1LMNANPC1MAPK1
SCHEMBL12808595 0.76 LMNA (0.38) MAPTALDH1A1LMNANPC1MAPK1
SCHEMBL19908573 0.73 TRPA1 (0.35) MAPTALDH1A1LMNANPC1MAPK1
SCHEMBL8750382 0.73 TRPA1 (0.35) MAPTALDH1A1LMNANPC1MAPK1
SCHEMBL26036773 0.71 ADRB2 (0.36) MAPTALDH1A1LMNANPC1MAPK1

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
JP-11080693-A — — None — — JP disclosed
JP-H1180693-A PRESSURE SENSITIVE ADHESIVE AND PLASTER SEKISUI CHEM CO LTD 1999-03-26 — — JP disclosed
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