SCHEMBL9749030

SCHEMBL9749030

Cc1cn2cccc(OCc3ccccc3C)c2n1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 8/20 0.53
PSEN2 P49810 8/20 0.53
APH1B Q8WW43 8/20 0.53
NCSTN Q92542 8/20 0.53
APH1A Q96BI3 8/20 0.53
PSENEN Q9NZ42 8/20 0.53
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
POLB P06746 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
CDK4 P11802 1/20 0.43
CCND1 P24385 1/20 0.43

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
SCHEMBL10673422 0.88 ABCB1 (0.45) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9747203 0.87 PSEN1 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9747708 0.87 PPARG (0.44) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10532132 0.87 GUCY1B2 (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9119050 0.86 PSEN1 (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL11073074 0.85 CYP3A4 (0.60) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8598209 0.85 PSEN1 (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8562655 0.84 PLK1 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10558610 0.84 PLAU (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2189993 0.83 ATP4A (0.60) PSEN1PSEN2APH1BNCSTNAPH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0204285-B1 IMIDAZOHETEROCYCLIC COMPOUNDS PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-01-15 EP disclosed
US-4725601-A Certain imidazo[1,2-a]pyridines useful in the treatment of ulcers FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-02-16 US disclosed
EP-0204285-A1 Imidazoheterocyclic compounds processes for preparation thereof and pharmaceutical compositions comprising them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-12-10 EP disclosed