SCHEMBL11583052

SCHEMBL11583052

Cc1cc(Cl)c2nc(CC#N)[nH]c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.41
▸ HRH4 Q9H3N8 1/20 0.40
▸ NUDT1 P36639 1/20 0.37
▸ PRKCZ Q05513 2/20 0.36
▸ GAA P10253 4/20 0.34
▸ KMT2A Q03164 4/20 0.33
▸ POLB P06746 2/20 0.33
▸ F10 P00742 1/20 0.33
▸ PSMB8 P28062 1/20 0.33
▸ TSHR P16473 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ DHODH Q02127 1/20 0.32
▸ PTGES O14684 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL11749738 0.86 GAA (0.40) HTTPRKCZGAAKMT2APOLB
SCHEMBL11583058 0.76 GAA (0.34) HTTGAAKMT2APOLB
SCHEMBL11574137 0.75 PSMB8 (0.59) NUDT1GAAKMT2APSMB8KDM4E
SCHEMBL13351311 0.74 RPS6KA3 (0.49) PRKCZGAAKMT2APOLBKDM4E
SCHEMBL31516298 0.72 KMT2A (0.66) HTTGAAKMT2APOLBKDM4E
SCHEMBL8985181 0.72 KMT2A (0.66) HTTGAAKMT2APOLBKDM4E
SCHEMBL6311477 0.71 GAA (0.62) HTTGAAKMT2AF10MEN1
SCHEMBL11669074 0.70 NUDT1 (0.60) HTTHRH4NUDT1GAAKMT2A
SCHEMBL6311538 0.69 MGAM (0.47) GAAALDH1A1
SCHEMBL8985172 0.69 KMT2A (0.49) HTTGAAKMT2APOLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4097484-A ORGANIC PIGMENTS, PLASTICS CIBA-GEIGY CORPORATION (US) 1978-06-27 — — US disclosed
US-4079052-A Diazopigments containing pyridine derivatives CIBA-GEIGY CORPORATION (US) 1978-03-14 — — US disclosed
US-4012371-A Benzinaldazolyl-, quinolonyl-, or phenmorpholonylazo-3-cyano-4-methyl-1,2-[1',2']-benz-[4',5']-imidazolo-6-hydroxypyridine colorants CIBA-GEIGY CORPORATION (US) 1977-03-15 — — US disclosed
US-4002635-A FOR COLORING PLASTICS AND LACQUERS CIBA-GEIGY CORPORATION (US) 1977-01-11 — — US disclosed
US-3994899-A METHINE CIBA-GEIGY CORPORATION (US) 1976-11-30 — — US disclosed
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