SCHEMBL22271073

SCHEMBL22271073

CCCc1ccc(CC(Nc2ccc(-c3nccnc3N(C)[C@@H](C)c3ccc(Cl)cc3)cc2)=C2CCC2)cc1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 1/20 0.32
▸ TNIK Q9UKE5 1/20 0.30

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
SCHEMBL22270887 0.84 KDM4E (0.40) TNIK
SCHEMBL22270563 0.77 WNT3A (0.39) —
SCHEMBL22271066 0.76 RORC (0.35) —
SCHEMBL22270880 0.75 LMNA (0.37) —
SCHEMBL22270671 0.74 RORC (0.39) —
SCHEMBL19205586 0.74 UTS2R (0.41) —
SCHEMBL22271062 0.73 LPAR1 (0.35) —
SCHEMBL22270885 0.73 RORC (0.35) —
SCHEMBL22270537 0.72 MAPT (0.36) —
SCHEMBL22270601 0.70 KDM4E (0.31) —

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
EP-3686187-A1 PROCESS FOR THE PREPARATION OF ROR GAMMA MODULATORS Glenmark Pharmaceuticals S.A. (CH) 2020-07-29 — — EP disclosed
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