SCHEMBL10529448

SCHEMBL10529448

Cc1cnc2c(-c3nnco3)c(Cl)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 2/20 0.47
▸ CCR5 P51681 2/20 0.47
▸ CCR8 P51685 2/20 0.47
▸ NOTUM Q6P988 9/20 0.40
▸ PSMD14 O00487 1/20 0.40
▸ COPS5 Q92905 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.37
▸ TSHR P16473 3/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ SLC40A1 Q9NP59 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ PARP1 P09874 1/20 0.33
▸ MAPK1 P28482 1/20 0.33

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
SCHEMBL10754090 0.71 NOTUM (0.44) CCR1CCR5CCR8NOTUMKDM4E
SCHEMBL8838409 0.71 CCR1 (0.67) CCR1CCR5CCR8PSMD14COPS5
SCHEMBL6888604 0.71 CCR1 (0.67) CCR1CCR5CCR8PSMD14COPS5
SCHEMBL29890061 0.71 CCR1 (0.67) CCR1CCR5CCR8PSMD14COPS5
SCHEMBL10531985 0.69 CCR1 (0.49) CCR1CCR5CCR8PSMD14COPS5
SCHEMBL22326612 0.68 CCR1 (0.62) CCR1CCR5CCR8PSMD14COPS5
SCHEMBL686948 0.68 CCR1 (1.00) CCR1CCR5CCR8PSMD14COPS5
SCHEMBL30492603 0.68 CCR1 (1.00) CCR1CCR5CCR8PSMD14COPS5
SCHEMBL27891657 0.67 CCR1 (0.60) CCR1CCR5CCR8PSMD14COPS5
SCHEMBL15077330 0.66 CCR1 (0.58) CCR1CCR5CCR8PSMD14COPS5

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
US-4797148-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1989-01-10 — — US disclosed
EP-0224823-A2 Quinoline derivatives and their use in combating unwanted plant growth BASF Aktiengesellschaft (DE) 1987-06-10 — — EP disclosed
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