SCHEMBL18484160

SCHEMBL18484160

C[C@H](Nc1nccnc1-c1ccc(N)cc1)c1cccc(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 3/20 0.44
▸ ADORA1 P30542 1/20 0.44
▸ ADORA2A P29274 1/20 0.44
▸ DYRK1A Q13627 1/20 0.44
▸ COASY Q13057 1/20 0.41
▸ RPS6KB1 P23443 2/20 0.41
▸ MAPK1 P28482 4/20 0.40
▸ MAPK3 P27361 1/20 0.40
▸ LDHA P00338 2/20 0.39
▸ LDHB P07195 2/20 0.39
▸ SOS1 Q07889 1/20 0.39
▸ AURKA O14965 1/20 0.39
▸ SCN1A P35498 1/20 0.38
▸ SCN5A Q14524 1/20 0.38
▸ SCN8A Q9UQD0 1/20 0.38
▸ ROCK2 O75116 1/20 0.38
▸ ROCK1 Q13464 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ MAPT P10636 1/20 0.38

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
SCHEMBL19205626 1.00 ADORA3 (0.44) ADORA3ADORA1ADORA2ADYRK1ACOASY
SCHEMBL22270670 0.87 DYRK1A (0.43) ADORA3ADORA1ADORA2ADYRK1ACOASY
SCHEMBL19205733 0.85 ATP1A1 (0.44) LDHALDHBP2RX3EGFRCDK1
SCHEMBL19205734 0.85 ATP1A1 (0.44) LDHALDHBP2RX3EGFRCDK1
SCHEMBL19205755 0.84 LDHA (0.48) LDHALDHBEGFR
SCHEMBL18448954 0.84 LDHA (0.48) LDHALDHBEGFR
SCHEMBL18484486 0.84 LDHA (0.48) LDHALDHBEGFR
SCHEMBL19205739 0.83 ALDH1A1 (0.46) ADORA3ADORA1ADORA2ADYRK1ACOASY
SCHEMBL18484150 0.78 EGFR (0.45) LDHALDHBPLK1P2RX3EGFR
SCHEMBL18484149 0.78 EGFR (0.45) LDHALDHBPLK1P2RX3EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108026050-B Novel compounds as ROR gamma modulators 格兰马克药品股份有限公司 2021-04-30 — — CN disclosed
US-10988467-B2 Compounds as ROR gamma modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2021-04-27 — — US disclosed
US-10988467-B2 Compounds as ROR gamma modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2021-04-27 — — US disclosed
EP-3686187-A1 PROCESS FOR THE PREPARATION OF ROR GAMMA MODULATORS Glenmark Pharmaceuticals S.A. (CH) 2020-07-29 — — EP disclosed
EP-3331863-B1 NOVEL COMPOUNDS AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS SA (CH) 2020-03-11 — — EP disclosed
US-20190256508-A1 NOVEL COMPOUNDS AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS SA (CH) 2019-08-22 — — US disclosed
US-20190256508-A1 NOVEL COMPOUNDS AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS SA (CH) 2019-08-22 — — US disclosed
US-10344024-B2 Compounds as ROR gamma modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2019-07-09 — — US disclosed
US-10344024-B2 Compounds as ROR gamma modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2019-07-09 — — US disclosed
US-20180237428-A1 NOVEL COMPOUNDS AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS SA (CH) 2018-08-23 — — US disclosed
US-9975887-B2 Compounds as ROR gamma modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2018-05-22 — — US disclosed
US-9975887-B2 Compounds as ROR gamma modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2018-05-22 — — US disclosed
US-9975887-B2 Compounds as ROR gamma modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2018-05-22 — — US disclosed
US-20170233380-A1 NOVEL COMPOUNDS AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2017-08-17 — — US disclosed
US-20170233380-A1 NOVEL COMPOUNDS AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2017-08-17 — — US disclosed
US-20170233380-A1 NOVEL COMPOUNDS AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2017-08-17 — — US disclosed
WO-2017021879-A1 NOVEL COMPOUNDS AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2017-02-09 — — 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 (5 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-10988467-B2 Compounds as ROR gamma modulators RORB, RORA, RORC ADORA3 916/4885ADORA1 897/4885ADORA2A 1755/4885
US-10344024-B2 Compounds as ROR gamma modulators RORB, RORA, RORC ADORA3 916/4885ADORA1 897/4885ADORA2A 1755/4885
US-20190256508-A1 NOVEL COMPOUNDS AS ROR GAMMA MODULATORS RORB, RORA, RORC ADORA3 826/4885ADORA1 818/4885ADORA2A 1726/4885
US-20180237428-A1 NOVEL COMPOUNDS AS ROR GAMMA MODULATORS RORB, RORA, RORC ADORA3 1968/4885ADORA1 1580/4885ADORA2A 2809/4885
US-20170233380-A1 NOVEL COMPOUNDS AS ROR GAMMA MODULATORS RORB, RORA, RORC ADORA3 826/4885ADORA1 818/4885ADORA2A 1726/4885

“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.

Send feedback