SCHEMBL16655059

SCHEMBL16655059

CC(C)(C)OC(=O)N1CC(Nc2ncc(Cl)c(-c3c[nH]c4ccccc34)n2)CC(C(=O)O)C1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 16/20 0.64
▸ MAPK9 P45984 16/20 0.64
▸ JUN P05412 15/20 0.64
▸ MAPK10 P53779 11/20 0.64
▸ CDK2 P24941 16/20 0.61
▸ CCNT1 O60563 4/20 0.56
▸ CCNK O75909 4/20 0.56
▸ CDK9 P50750 4/20 0.56
▸ CDK12 Q9NYV4 4/20 0.56
▸ CCNE1 P24864 3/20 0.56
▸ CDK7 P50613 2/20 0.55
▸ CCNH P51946 2/20 0.55
▸ MNAT1 P51948 2/20 0.55

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
SCHEMBL25327210 0.93 MAPK8 (0.74) MAPK8MAPK9JUNMAPK10CDK2
SCHEMBL16655043 0.89 MAPK8 (0.60) MAPK8MAPK9JUNMAPK10CDK2
SCHEMBL25331465 0.88 MAPK8 (0.75) MAPK8MAPK9JUNMAPK10CDK2
SCHEMBL31006768 0.88 MAPK8 (0.75) MAPK8MAPK9JUNMAPK10CDK2
SCHEMBL25331472 0.88 MAPK8 (0.75) MAPK8MAPK9JUNMAPK10CDK2
SCHEMBL29613421 0.87 CDK2 (0.76) MAPK8MAPK9JUNMAPK10CDK2
SCHEMBL16655000 0.86 CDK2 (0.69) MAPK8MAPK9JUNMAPK10CDK2
SCHEMBL16655050 0.86 CDK2 (0.69) MAPK8MAPK9JUNMAPK10CDK2
SCHEMBL16654998 0.86 CDK2 (0.69) MAPK8MAPK9JUNMAPK10CDK2
SCHEMBL18074109 0.86 CDK2 (0.69) MAPK8MAPK9JUNMAPK10CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190292167-A1 HETEROAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES SYROS PHARMACEUTICALS INC (US) 2019-09-26 — — US disclosed
US-20190292167-A1 HETEROAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES SYROS PHARMACEUTICALS INC (US) 2019-09-26 — — US disclosed
US-20160264552-A1 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLFERATIVE DISEASES SYROS PHARMACEUTICALS INC (US) 2016-09-15 — — US disclosed
US-20160264552-A1 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLFERATIVE DISEASES SYROS PHARMACEUTICALS INC (US) 2016-09-15 — — US disclosed
US-20160264552-A1 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLFERATIVE DISEASES SYROS PHARMACEUTICALS INC (US) 2016-09-15 — — US disclosed
EP-3057954-A2 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES Syros Pharmaceuticals, Inc. (US) 2016-08-24 — — EP disclosed
WO-2015058163-A2 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2015-04-23 — — WO disclosed
WO-2015058163-A2 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2015-04-23 — — 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 (2 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-20190292167-A1 HETEROAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES CDK7, CDK3, CDK17 MAPK8 352/4885MAPK9 506/4885JUN 139/4885
US-20160264552-A1 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLFERATIVE DISEASES CDK7, CDK6, CDK3 MAPK8 532/4885MAPK9 599/4885JUN 111/4885

“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