Quinoline

Quinoline

SCHEMBL27880973

CN1CC[C@]23c4c5ccc(OC(=O)c6ccccc6)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5.c1ccc2ncccc2c1

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 8/20 0.65
OPRM1 P35372 6/20 0.61
OPRK1 P41145 4/20 0.61
MRGPRX2 Q96LB1 4/20 0.61
ADRB1 P08588 1/20 0.61
PDE4D Q08499 1/20 0.61
PDE3A Q14432 1/20 0.61
SLC22A1 O15245 1/20 0.55
ADRA2A P08913 1/20 0.55
ARRB1 P49407 1/20 0.55

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
Quinoline SCHEMBL27419680 0.92 OPRM1 (0.63) OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL6459794 0.91 OPRD1 (0.77) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Codeine SCHEMBL28269801 0.89 OPRM1 (0.78) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Quinoline SCHEMBL27847357 0.88 OPRM1 (0.63) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Quinoline SCHEMBL27736709 0.88 OPRD1 (0.65) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Ethylmorphine SCHEMBL27702598 0.88 OPRD1 (0.65) OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL12082084 0.87 OPRD1 (0.76) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Ethylmorphine SCHEMBL27816812 0.87 OPRM1 (0.64) OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL27496008 0.87 OPRD1 (0.66) OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL12082085 0.86 OPRD1 (0.73) OPRD1OPRM1OPRK1MRGPRX2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102584668-A Method for preparing 2,3-dibromo-5-benzoyl pyrrole SYNCHEM BENGBU TECHNOLOLY CO LTD 2012-07-18 CN disclosed