SCHEMBL19369166

SCHEMBL19369166

Cc1cnn(C)c1-c1ccc(C(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.43
MAPT P10636 3/20 0.43
LMNA P02545 2/20 0.43
KDM4E B2RXH2 1/20 0.43
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
PDE2A O00408 1/20 0.42
TMEM97 Q5BJF2 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
CASR P41180 2/20 0.38
DGAT1 O75907 1/20 0.37
BRD4 O60885 1/20 0.36
CREBBP Q92793 1/20 0.36
TP53 P04637 2/20 0.36
GAA P10253 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
DHODH Q02127 1/20 0.35
PDE10A Q9Y233 1/20 0.35
NPC1 O15118 2/20 0.35

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
SCHEMBL25615539 0.86 ADRB2 (0.37) RAB9AMAPTLMNAKDM4EPRMT5
Hydrochloric Acid SCHEMBL25211383 0.85 ADRB2 (0.36) RAB9AMAPTLMNAKDM4EPRMT5
Hydrochloric Acid SCHEMBL25268178 0.85 ADRB2 (0.36) RAB9AMAPTLMNAKDM4EPRMT5
SCHEMBL23087462 0.82 HTR2A (0.46) RAB9AMAPTLMNAKDM4EPRMT5
SCHEMBL12856337 0.81 PDE2A (0.43) RAB9AMAPTPRMT5WDR77PDE2A
SCHEMBL31306342 0.81 ALDH1A1 (0.41) RAB9AMAPTKDM4EPRMT5WDR77
SCHEMBL14996666 0.81 PDE2A (0.41) RAB9ALMNAPRMT5WDR77PDE2A
SCHEMBL27405097 0.80 BRD4 (0.47) RAB9AMAPTLMNAKDM4EPRMT5
SCHEMBL21051439 0.78 NPC1 (0.42) RAB9AMAPTKDM4EBRD4CREBBP
SCHEMBL27037461 0.78 PDE2A (0.43) RAB9AMAPTLMNAKDM4EPDE2A

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
US-9763922-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2017-09-19 US disclosed