SCHEMBL9622727

SCHEMBL9622727

COc1ccc2c(c1)N(C)C(=C1C(=O)N(c3ccccc3)N=C1C)S2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 11/20 0.52
▸ NPSR1 Q6W5P4 2/20 0.52
▸ KDM4E B2RXH2 2/20 0.52
▸ MEN1 O00255 9/20 0.47
▸ MAPT P10636 7/20 0.46
▸ ALDH1A1 P00352 4/20 0.45
▸ RXFP1 Q9HBX9 2/20 0.45
▸ TP53 P04637 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ CASP1 P29466 1/20 0.41
▸ CASP7 P55210 1/20 0.41
▸ ESR2 Q92731 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ GAA P10253 3/20 0.41
▸ POLB P06746 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ THRB P10828 1/20 0.39

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
SCHEMBL9622679 0.85 KMT2A (0.45) KMT2ANPSR1KDM4EMEN1MAPT
SCHEMBL9622698 0.84 ALDH1A1 (0.50) KMT2AKDM4EMEN1MAPTALDH1A1
SCHEMBL14063194 0.72 MEN1 (0.39) KMT2ANPSR1MEN1MAPTALDH1A1
SCHEMBL9622414 0.72 MAPT (0.53) KMT2ANPSR1KDM4EMEN1MAPT
SCHEMBL9622105 0.72 MAPT (0.50) KMT2ANPSR1MEN1MAPTALDH1A1
SCHEMBL12221149 0.70 MAPT (0.54) KMT2AKDM4EMEN1MAPTALDH1A1
SCHEMBL12291974 0.70 MAPT (0.64) KMT2AKDM4EMEN1MAPTALDH1A1
SCHEMBL12221126 0.69 KMT2A (0.49) KMT2AKDM4EMEN1MAPTALDH1A1
SCHEMBL9153484 0.68 MAPT (0.47) KMT2ANPSR1KDM4EMEN1MAPT
SCHEMBL9156158 0.67 MAPT (0.55) KMT2AKDM4EMEN1MAPTALDH1A1

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-0467155-A1 Blue spectral sensitizers for non-tabular silver halide elements E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-01-22 — — EP claimed
US-5102781-A Used for radiographic elements designed for exposure to intensifying screens E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-04-07 — — US disclosed
EP-0467155-A1 Blue spectral sensitizers for non-tabular silver halide elements E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-01-22 — — EP disclosed
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