SCHEMBL145371

SCHEMBL145371

N[C@@H]1C[C]1c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 12/20 0.44
KDM1A O60341 10/20 0.44
ALDH1A1 P00352 1/20 0.44
MAOA P21397 9/20 0.40
CYP2C19 P33261 4/20 0.40
CYP2B6 P20813 3/20 0.40
TAAR1 Q96RJ0 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2D6 P10635 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP3A4 P08684 2/20 0.40
HSD17B10 Q99714 2/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A3 Q01959 2/20 0.40
LMNA P02545 2/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
CYP2A6 P11509 1/20 0.40
HTR2C P28335 1/20 0.40
ADRA1A P35348 1/20 0.40

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
SCHEMBL9130854 0.74 ALDH1A1 (0.42) MAOBKDM1AALDH1A1MAOAHTR2C
SCHEMBL695560 0.74 ALDH1A1 (0.42) MAOBKDM1AALDH1A1TAAR1CYP1A2
SCHEMBL17652437 0.74 ALDH1A1 (0.42) MAOBKDM1AALDH1A1MAOATAAR1
SCHEMBL28431861 0.74 ALDH1A1 (0.42) MAOBKDM1AALDH1A1MAOAHTR2C
SCHEMBL14974371 0.74 ALDH1A1 (0.42) MAOBKDM1AALDH1A1HSD17B10
Biphenyl SCHEMBL27474545 0.73 ALDH1A1 (0.56) MAOBKDM1AALDH1A1MAOACYP2C19
Biphenyl SCHEMBL2574161 0.66 ALDH1A1 (0.82) ALDH1A1MAOATAAR1CYP1A2CYP3A4
Biphenyl SCHEMBL9388941 0.66 ALDH1A1 (0.82) ALDH1A1MAOACYP2B6TAAR1CYP1A2
Biphenyl SCHEMBL164 0.65 ALDH1A1 (1.00) ALDH1A1MAOACYP2B6TAAR1CYP1A2
Biphenyl SCHEMBL2548048 0.65 ALDH1A1 (1.00) ALDH1A1MAOACYP2B6TAAR1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130143824-A1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH, INC. (US) 2013-06-06 US disclosed
US-20120058953-A1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH, INC. (US) 2012-03-08 US disclosed
US-20110039324-A1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH, INC. (US) 2011-02-17 US disclosed
US-20090148921-A1 Compositions and methods for enhancing apoptosis GENENTECH, INC. (US) 2009-06-11 US disclosed
US-20040171554-A1 Compositions and methods for enhancing apoptosis GENENTECH, INC. 2004-09-02 US disclosed