SCHEMBL9622698

SCHEMBL9622698

CC1=NN(c2ccccc2)C(=O)C1=C1Sc2ccccc2N1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ CYP1A2 P05177 2/20 0.50
▸ TP53 P04637 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ MAPT P10636 13/20 0.48
▸ KMT2A Q03164 13/20 0.48
▸ MEN1 O00255 10/20 0.48
▸ GAA P10253 4/20 0.48
▸ L3MBTL1 Q9Y468 8/20 0.43
▸ MAPK1 P28482 8/20 0.43
▸ TDP1 Q9NUW8 6/20 0.43
▸ LMNA P02545 4/20 0.43
▸ HTT P42858 4/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ KDM4E B2RXH2 5/20 0.42
▸ HPGD P15428 2/20 0.41
▸ PKM P14618 1/20 0.41
▸ MAOA P21397 1/20 0.41

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 0.86 KMT2A (0.45) ALDH1A1NPC1CYP1A2TP53CYP2C19
SCHEMBL9622727 0.84 KMT2A (0.52) ALDH1A1NPC1TP53RAB9AMAPT
SCHEMBL9622414 0.84 MAPT (0.53) ALDH1A1NPC1MAPTKMT2AMEN1
SCHEMBL9156158 0.79 MAPT (0.55) ALDH1A1TP53MAPTKMT2AMEN1
SCHEMBL13739541 0.78 ALDH1A1 (0.57) ALDH1A1NPC1CYP1A2TP53CYP2C19
Potassium Ion SCHEMBL9155095 0.78 KDM4E (0.44) ALDH1A1NPC1MAPTKMT2AMEN1
SCHEMBL12291974 0.77 MAPT (0.64) ALDH1A1CYP1A2MAPTKMT2AMEN1
SCHEMBL12221149 0.74 MAPT (0.54) ALDH1A1CYP1A2MAPTKMT2AMEN1
SCHEMBL9622105 0.74 MAPT (0.50) ALDH1A1NPC1CYP1A2TP53CYP2C19
SCHEMBL11040384 0.72 ALDH1A1 (0.45) ALDH1A1NPC1MAPTKMT2AMEN1

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
Send feedback