SCHEMBL9540049

SCHEMBL9540049

Nc1ccc(Cl)cc1C(=O)c1cc(Cl)ccc1N

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.79
FADS1 O60427 1/20 0.59
NOS2 P35228 2/20 0.54
SMN1; SMN2 Q16637 3/20 0.53
GFER P55789 1/20 0.53
KMT2A Q03164 1/20 0.53
ALDH1A1 P00352 5/20 0.52
CYP3A4 P08684 3/20 0.52
TSHR P16473 2/20 0.52
ALOX15 P16050 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
KDM4E B2RXH2 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
ABL1 P00519 1/20 0.48
TP53 P04637 1/20 0.48
GCK P35557 2/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
HPGD P15428 1/20 0.46

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
SCHEMBL3253860 0.92 RECQL (0.80) RECQLFADS1NOS2SMN1; SMN2GFER
SCHEMBL11624724 0.90 RECQL (0.77) RECQLFADS1NOS2SMN1; SMN2KMT2A
SCHEMBL333313 0.89 RECQL (1.00) RECQLFADS1SMN1; SMN2GFERKMT2A
SCHEMBL29516764 0.89 RECQL (1.00) RECQLFADS1SMN1; SMN2GFERKMT2A
SCHEMBL6351799 0.88 RECQL (0.64) RECQLFADS1NOS2SMN1; SMN2GFER
SCHEMBL28356361 0.87 RECQL (0.73) RECQLFADS1SMN1; SMN2GFERKMT2A
Hydrochloric Acid SCHEMBL8835389 0.87 RECQL (0.97) RECQLFADS1SMN1; SMN2GFERKMT2A
Hydrazine SCHEMBL11776632 0.87 RECQL (0.97) RECQLFADS1SMN1; SMN2GFERKMT2A
SCHEMBL6954318 0.87 RECQL (0.73) RECQLFADS1NOS2SMN1; SMN2GFER
SCHEMBL30484136 0.86 RECQL (0.67) RECQLSMN1; SMN2GFERKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1070369-C Alteration of hair growth KASZYNSKI EDWIN G (US) 2001-09-05 CN disclosed
CN-1071917-A Quinazoline derivant as human immunodeficiency virus reversed transcriptive enzyme antagonist MERCK & CO INC (US) 1993-05-12 CN disclosed
EP-0530994-A1 Quinazoline derivatives as inhibitors of HIV reverse transcriptase MERCK & CO. INC. (US) 1993-03-10 EP disclosed
WO-1993004047-A1 QUINAZOLINE DERIVATIVES AS INHIBITORS OF HIV REVERSE TRANSCRIPTASE MERCK & CO., INC. (US) 1993-03-04 WO disclosed
CN-1047620-A Alteration of hair growth KASZYNSKI EDWIN G (US) 1990-12-12 CN disclosed
CN-85101410-A Alteration of hair growth 1987-01-10 CN disclosed