SCHEMBL17317439

SCHEMBL17317439

O=[PH](c1ccc(Cc2ccccc2)cc1)c1ccc(Cc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CALM1 P0DP23 1/20 0.57
▸ PLA2G10 O15496 1/20 0.47
▸ PLA2G2A P14555 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ LTA4H P09960 2/20 0.45
▸ IDH1 O75874 1/20 0.43
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ CA14 Q9ULX7 1/20 0.42
▸ HNF4A P41235 1/20 0.41
▸ SLC22A2 O15244 1/20 0.41
▸ MAOB P27338 1/20 0.39
▸ PRSS1 P07477 1/20 0.38
▸ PRSS2 P07478 1/20 0.38
▸ PRSS3 P35030 1/20 0.38
▸ PPARG P37231 3/20 0.38
▸ PPARA Q07869 3/20 0.38
▸ SRD5A2 P31213 1/20 0.37

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
SCHEMBL9441909 0.82 CALM1 (0.52) CALM1PLA2G10PLA2G2ALMNALTA4H
SCHEMBL821938 0.79 ALDH1A1 (0.33) LMNACA12CA1CA2CA9
SCHEMBL8094422 0.79 CALM1 (0.92) CALM1PLA2G10PLA2G2ALMNALTA4H
SCHEMBL972712 0.79 CALM1 (0.92) CALM1PLA2G10PLA2G2ALMNALTA4H
SCHEMBL2154168 0.77 TP53 (0.54) LMNACA2PPARGPPARACYP2C9
Diphenylmethane SCHEMBL1537806 0.77 CALM1 (0.67) CALM1PLA2G10PLA2G2ALMNALTA4H
Hydrochloric Acid SCHEMBL27978245 0.76 CALM1 (0.86) CALM1PLA2G10PLA2G2ALMNALTA4H
SCHEMBL13583073 0.76 ALDH1A1 (0.35) LMNACA12CA1CA2CA9
SCHEMBL1667 0.76 ALDH1A1 (0.35) LMNACA12CA1CA2CA9
Diphenylmethane SCHEMBL4361124 0.76 CALM1 (1.00) CALM1PLA2G10PLA2G2ALMNALTA4H

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-3114191-A1 SEQUENTIAL FUNCTIONALISATION OF PHOSPHORESCENT EMITTER LAYERS Siemens Aktiengesellschaft (DE) 2017-01-11 — — EP disclosed
WO-2015185482-A1 SEQUENTIAL FUNCTIONALISATION OF PHOSPHORESCENT EMITTER LAYERS SIEMENS AKTIENGESELLSCHAFT (DE) 2015-12-10 — — WO disclosed
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