Quinoline

Quinoline

SCHEMBL28167828

NC(=O)c1ccc(-c2c3nc(c(-c4ccc(C(N)=O)cc4)c4ccc([nH]4)c(-c4ccc(C(N)=O)cc4)c4nc(c(-c5ccc(C(N)=O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1.c1ccc2ncccc2c1

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 4/20 0.55
▸ CYCS P99999 3/20 0.54
▸ RIPK1 Q13546 1/20 0.50
▸ ENPP2 Q13822 1/20 0.44
▸ ABCG2 Q9UNQ0 1/20 0.42
▸ CAMKK2 Q96RR4 1/20 0.42
▸ CHEK2 O96017 3/20 0.42
▸ AR P10275 1/20 0.42
▸ MKNK1 Q9BUB5 2/20 0.41
▸ MKNK2 Q9HBH9 2/20 0.41
▸ TERT O14746 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
SCHEMBL27814176 0.85 TOP1 (0.71) TOP1CYCSENPP2ABCG2CHEK2
SCHEMBL28167771 0.85 TOP1 (0.74) TOP1CYCSRIPK1ENPP2ABCG2
Quinoline SCHEMBL28173578 0.84 TOP1 (0.63) TOP1CYCSRIPK1ENPP2TERT
Quinoline SCHEMBL28121893 0.82 TOP1 (0.60) TOP1CYCSRIPK1ENPP2TERT
Quinoline SCHEMBL14720516 0.75 ALDH1A1 (0.61) RIPK1ARMKNK1MKNK2
SCHEMBL5012384 0.75 TOP1 (0.60) TOP1CYCSENPP2ABCG2TERT
SCHEMBL25395869 0.74 TOP1 (0.91) TOP1CYCSENPP2ABCG2TERT
SCHEMBL25394852 0.74 TOP1 (0.91) TOP1CYCSENPP2ABCG2TERT
SCHEMBL16418477 0.74 TOP1 (0.91) TOP1CYCSENPP2ABCG2TERT
SCHEMBL29556585 0.74 TOP1 (0.91) TOP1CYCSENPP2ABCG2TERT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106955605-B Polyamide VOCs (volatile organic compounds) interception type polymer separation membrane and preparation method thereof 南京工业大学 2019-10-11 — — CN disclosed
CN-106955605-A Polyamide VOCs (volatile organic compounds) interception type polymer separation membrane and preparation method thereof 南京工业大学 2017-07-18 — — CN disclosed
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