SCHEMBL11244190

SCHEMBL11244190

CN1C=CN(CC(=O)c2ccc(Cl)cc2)C1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CXCR3 P49682 7/20 0.45
▸ RAB9A P51151 3/20 0.44
▸ GSK3B P49841 2/20 0.44
▸ KMT2A Q03164 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MITF O75030 1/20 0.40
▸ S1PR4 O95977 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ S1PR1 P21453 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL12220178 0.89 GSK3B (0.52) CXCR3RAB9AGSK3BKMT2AALDH1A1
Bromide SCHEMBL2532767 0.87 RAB9A (0.51) CXCR3RAB9AGSK3BKMT2AALDH1A1
SCHEMBL10531146 0.86 KMT2A (0.50) RAB9AGSK3BKMT2AALDH1A1MAPT
Bromide SCHEMBL10529429 0.84 HSD17B3 (0.42) RAB9AALDH1A1POLBNPC1L3MBTL1
Hydrochloric Acid SCHEMBL10531143 0.84 KMT2A (0.49) RAB9AGSK3BKMT2AALDH1A1MAPT
Bromide SCHEMBL10528564 0.84 KMT2A (0.49) RAB9AGSK3BKMT2AALDH1A1MAPT
SCHEMBL28841430 0.84 ALDH1A1 (0.48) CXCR3RAB9AGSK3BKMT2AALDH1A1
SCHEMBL28841390 0.84 ALDH1A1 (0.44) RAB9AGSK3BKMT2AALDH1A1MAPT
SCHEMBL28841400 0.84 ALDH1A1 (0.51) CXCR3RAB9AKMT2AALDH1A1MAPT
SCHEMBL29793862 0.84 ALDH1A1 (0.51) CXCR3RAB9AKMT2AALDH1A1MAPT

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
CN-108690217-B Carbon fiber recycling composition and method 波音公司 2022-07-15 — — CN claimed
CN-108690217-B Carbon fiber recycling composition and method 波音公司 2022-07-15 — — CN disclosed
US-4351948-A Imidazole hydrazone derivatives G.D. SEARLE & CO. (US) 1982-09-28 — — US disclosed
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