SCHEMBL22271062

SCHEMBL22271062

CCCc1ccc(CC(Nc2ccc(-c3nccnc3OC(C)c3ccccc3Cl)cc2)=C2CCC2)cc1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 8/20 0.35
▸ RORC P51449 3/20 0.34
▸ LPAR2 Q9HBW0 1/20 0.33
▸ LPAR3 Q9UBY5 1/20 0.33
▸ RORB Q92753 1/20 0.32
▸ KDR P35968 1/20 0.31
▸ TRPV4 Q9HBA0 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
SCHEMBL22270671 0.88 RORC (0.39) LPAR1RORCLPAR3RORBKDR
SCHEMBL22270885 0.86 RORC (0.35) RORCKDR
SCHEMBL22270563 0.81 WNT3A (0.39) RORCKDR
SCHEMBL22270886 0.78 L3MBTL1 (0.35) —
SCHEMBL22270668 0.78 KDR (0.36) RORCKDR
SCHEMBL22270887 0.75 KDM4E (0.40) —
SCHEMBL22270537 0.75 MAPT (0.36) KDR
SCHEMBL22270880 0.74 LMNA (0.37) KDR
SCHEMBL19205794 0.74 RORC (0.44) LPAR1RORCLPAR2LPAR3RORB
SCHEMBL18447804 0.74 RORC (0.44) LPAR1RORCLPAR2LPAR3RORB

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
Send feedback