SCHEMBL24375975

SCHEMBL24375975

c1ccccccc(NCCc2ccccccccc2)cccccc1

nearest known ligand 0.95

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.95
ALDH1A1 P00352 2/20 0.61
MAPT P10636 2/20 0.61
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
MAOA P21397 2/20 0.56
MAOB P27338 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
ATM Q13315 1/20 0.56
TAAR1 Q96RJ0 1/20 0.56
KDM1A O60341 1/20 0.56
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
HTR1A P08908 1/20 0.56
ADRA2A P08913 1/20 0.56
CYP2C8 P10632 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
IDO1 P14902 1/20 0.56

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
SCHEMBL88597 1.00 L3MBTL1 (0.95) L3MBTL1ALDH1A1MAPTNPC1RAB9A
SCHEMBL21186859 1.00 L3MBTL1 (0.95) L3MBTL1ALDH1A1MAPTNPC1RAB9A
Hydrochloric Acid SCHEMBL8746161 0.98 L3MBTL1 (1.00) L3MBTL1ALDH1A1MAPTNPC1RAB9A
SCHEMBL10055000 0.95 L3MBTL1 (0.86) L3MBTL1ALDH1A1MAPTNPC1RAB9A
SCHEMBL11653014 0.95 L3MBTL1 (0.86) L3MBTL1ALDH1A1MAPTNPC1RAB9A
SCHEMBL819106 0.91 L3MBTL1 (0.80) L3MBTL1ALDH1A1MAPTNPC1RAB9A
SCHEMBL17040434 0.87 L3MBTL1 (0.73) L3MBTL1ALDH1A1MAPTNPC1RAB9A
SCHEMBL2311052 0.87 L3MBTL1 (0.73) L3MBTL1ALDH1A1MAPTNPC1RAB9A
SCHEMBL3910280 0.87 L3MBTL1 (0.73) L3MBTL1ALDH1A1MAPTNPC1RAB9A
SCHEMBL24641654 0.87 L3MBTL1 (0.73) L3MBTL1ALDH1A1MAPTNPC1RAB9A

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-3988098-A1 HETEROCYCLO ALKYL COMPOUNDS USED AS CCR2/CCR5 ANTAGONIST Shenzhen Lingfang Biotech Co., Ltd (CN) 2022-04-27 EP disclosed