SCHEMBL22901540

SCHEMBL22901540

COc1cccc2ccc(-c3ccccn3)nc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.56
TP53 P04637 5/20 0.56
ALOX15 P16050 3/20 0.56
HSD17B10 Q99714 2/20 0.56
ALDH1A1 P00352 2/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
HPGD P15428 1/20 0.56
CYP2C19 P33261 1/20 0.56
CBFB Q13951 1/20 0.56
PDE10A Q9Y233 1/20 0.54
MCHR1 Q99705 1/20 0.53
LMNA P02545 5/20 0.52
KDM4E B2RXH2 5/20 0.52
L3MBTL1 Q9Y468 4/20 0.52
TDP1 Q9NUW8 2/20 0.52
CCR1 P32246 2/20 0.52
CCR5 P51681 2/20 0.52
CCR8 P51685 2/20 0.52
HTT P42858 2/20 0.52

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
SCHEMBL19603062 0.87 MCHR1 (0.67) ALDH1A1CYP3A4HPGDPDE10AMCHR1
SCHEMBL22901625 0.84 PDE10A (0.56) SMN1; SMN2TP53ALOX15HSD17B10ALDH1A1
SCHEMBL4450069 0.84 MCHR1 (0.56) SMN1; SMN2TP53ALOX15HSD17B10ALDH1A1
SCHEMBL22901618 0.80 MAPT (0.52) SMN1; SMN2HTTMEN1KMT2AMAPT
SCHEMBL12817468 0.79 KDM4E (0.67) SMN1; SMN2TP53ALOX15HSD17B10ALDH1A1
SCHEMBL3245836 0.79 L3MBTL1 (0.58) SMN1; SMN2TP53ALOX15HSD17B10ALDH1A1
SCHEMBL2036823 0.79 MCHR1 (0.57) SMN1; SMN2ALOX15HSD17B10ALDH1A1HPGD
SCHEMBL8889339 0.79 MCHR1 (0.57) SMN1; SMN2ALDH1A1HPGDPDE10AMCHR1
SCHEMBL19618957 0.78 MEN1 (0.53) TP53ALOX15HSD17B10ALDH1A1CYP3A4
SCHEMBL5681545 0.78 SMN1; SMN2 (0.60) SMN1; SMN2TP53ALOX15HSD17B10ALDH1A1

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
EP-4686366-A1 THE USE OF QUINOLIN-8-OLATE DERIVATIVES AND A DEVICE COMPRISING THE SAME Noctiluca S.A. (PL) 2026-01-28 EP disclosed
WO-2021008588-A1 CLASS OF PYRIMIDINE QUINOLINE DERIVATIVES AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 广州新民培林医药科技有限公司 2021-01-21 WO disclosed