SCHEMBL6277979

SCHEMBL6277979

Cc1cc(C)c2c(c1)-c1ccccc1C2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.41
ALDH1A1 P00352 3/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PGR P06401 2/20 0.38
ACHE P22303 1/20 0.38
MAOA P21397 2/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
GAA P10253 2/20 0.36
CASP6 P55212 2/20 0.36

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
SCHEMBL6906767 0.86 MAOA (0.55) ALDH1A1NPC1RAB9AMAPTKDM4E
SCHEMBL23272970 0.82 METAP1 (0.46) ALDH1A1RAB9AMAPTKDM4EHPGD
SCHEMBL27493543 0.81 PGR (0.39) PNMTALDH1A1NPC1RAB9AMAPT
SCHEMBL30554482 0.81 KDR (0.41) PNMTALDH1A1NPC1RAB9AMAPT
SCHEMBL3984329 0.78 ACHE (0.40) ALDH1A1MAPTKDM4EACHEKMT2A
SCHEMBL27878508 0.78 PNMT (0.53) PNMTALDH1A1NPC1RAB9AMAPT
SCHEMBL135721 0.78 PNMT (0.53) PNMTALDH1A1NPC1RAB9AMAPT
SCHEMBL27610293 0.78 TSHR (0.36) PNMTALDH1A1NPC1RAB9AMAPT
SCHEMBL25337616 0.77 PNMT (0.41) PNMTALDH1A1NPC1RAB9AMAPT
SCHEMBL7523105 0.77 PNMT (0.45) PNMTALDH1A1NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1424918-B1 METHOD OF TREATING HAIR WITH HEAT AND A CAP WHICH PROVIDES A SIGNAL REGARDING TREATMENT UNILEVER PLC (GB) 2005-11-23 EP claimed