SCHEMBL16797124

SCHEMBL16797124

CCOC(=O)c1ccc(-n2nc(C(=O)c3c(Cl)cccc3Cl)c3cccc(F)c32)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RORC P51449 7/20 0.52
RARG P13631 1/20 0.49
ALDH1A1 P00352 5/20 0.46
NPSR1 Q6W5P4 3/20 0.46
CYP3A4 P08684 3/20 0.45
CYP2C9 P11712 3/20 0.45
RXFP1 Q9HBX9 2/20 0.45
MAPT P10636 2/20 0.44
TP53 P04637 1/20 0.44
TRPV4 Q9HBA0 1/20 0.42
CYP2C19 P33261 1/20 0.42
POLB P06746 1/20 0.41
NPBWR1 P48145 1/20 0.41
MCHR1 Q99705 1/20 0.41

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
SCHEMBL18205763 0.90 RORC (0.43) RORCRARGALDH1A1NPSR1CYP3A4
SCHEMBL16797277 0.86 RORC (0.71) RORCRARGALDH1A1CYP3A4CYP2C9
SCHEMBL16797248 0.84 RORC (0.71) RORCRARGCYP3A4CYP2C9CYP2C19
SCHEMBL16797121 0.83 RORC (0.51) RORCRARGALDH1A1NPSR1CYP3A4
SCHEMBL16797175 0.79 RORC (0.63) RORCRARGCYP3A4CYP2C9CYP2C19
SCHEMBL16797114 0.79 RORC (0.53) RORCRARGALDH1A1NPSR1CYP3A4
SCHEMBL17977788 0.78 RORC (0.44) RORCALDH1A1NPSR1CYP3A4CYP2C9
SCHEMBL18205745 0.77 RORC (0.52) RORCRARGALDH1A1CYP3A4CYP2C9
SCHEMBL18205758 0.75 RORC (0.44) RORCRARGALDH1A1CYP3A4CYP2C9
SCHEMBL16797231 0.74 RORC (0.58) RORCRARGCYP3A4CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3080090-B1 BICYCLIC HETEROARYL INDOLE ANALOGUES USEFUL AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS SA (CH) 2018-01-31 EP disclosed
US-9682977-B2 Bicyclic heteroaryl indole analogues useful as ROR gamma modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2017-06-20 US disclosed
US-20160326163-A1 BICYCLIC HETEROARYL INDOLE ANALOGUES USEFUL AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2016-11-10 US disclosed
EP-3080090-A1 BICYCLIC HETEROARYL INDOLE ANALOGUES USEFUL AS ROR GAMMA MODULATORS Glenmark Pharmaceuticals S.A. (CH) 2016-10-19 EP disclosed
WO-2015087234-A1 BICYCLIC HETEROARYL INDOLE ANALOGUES USEFUL AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2015-06-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160326163-A1 BICYCLIC HETEROARYL INDOLE ANALOGUES USEFUL AS ROR GAMMA MODULATORS RORA, RORB, RORC RORC 3/4885RARG 27/4885ALDH1A1 1211/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.