SCHEMBL9732928

SCHEMBL9732928

COc1cc(C)c2c(c1)c(C=O)cn2Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
P2RX7 Q99572 3/20 0.43
PLA2G2A P14555 2/20 0.42
ALDH1A1 P00352 5/20 0.42
LMNA P02545 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
HTT P42858 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
BCHE P06276 1/20 0.41
HTR6 P50406 1/20 0.41
HRH1 P35367 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
SCHEMBL9584018 0.80 PLA2G2A (0.61) PLA2G2AALDH1A1LMNABCHEHTR6
SCHEMBL28239560 0.76 POLB (0.60) POLBL3MBTL1ALDH1A1LMNASMN1; SMN2
SCHEMBL9732943 0.76 ALDH1A1 (0.47) POLBP2RX7ALDH1A1LMNASMN1; SMN2
SCHEMBL28524187 0.74 LTB4R (0.57) POLBL3MBTL1PLA2G2AALDH1A1LMNA
SCHEMBL9732936 0.73 MAPT (0.54) POLBALDH1A1LMNASMN1; SMN2TDP1
SCHEMBL5409497 0.73 MEN1 (0.42) ALDH1A1MEN1KMT2AHTR6
SCHEMBL797463 0.72 ALDH1A1 (0.69) POLBL3MBTL1ALDH1A1LMNASMN1; SMN2
SCHEMBL9733117 0.72 ALDH1A1 (0.67) POLBL3MBTL1ALDH1A1LMNASMN1; SMN2
SCHEMBL9732575 0.71 ALDH1A1 (0.49) POLBP2RX7PLA2G2AALDH1A1LMNA
SCHEMBL9732913 0.71 LTB4R (0.59) POLBPLA2G2AALDH1A1LMNASMN1; SMN2

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
WO-1992007829-A1 INDOLE-3-METHANAMINES USEFUL AS ANTI-DIABETIC, ANTI-OBESITY AND ANTI-ATHEROSCLEROTIC AGENTS THE UPJOHN COMPANY (US) 1992-05-14 WO disclosed