SCHEMBL18047408

SCHEMBL18047408

CN(C)CC=CC(=O)Nc1ccc(C(=O)N2CCC(Nc3ncc(Cl)c(-c4cccnc4)n3)CC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 7/20 0.66
▸ MAPK9 P45984 7/20 0.66
▸ CCNK O75909 13/20 0.65
▸ CDK12 Q9NYV4 13/20 0.65
▸ CDK7 P50613 10/20 0.65
▸ CCNH P51946 10/20 0.65
▸ CCNA2 P20248 8/20 0.65
▸ CDK2 P24941 8/20 0.65
▸ CDK9 P50750 6/20 0.65
▸ CDK13 Q14004 6/20 0.65
▸ CCNT1 O60563 5/20 0.65
▸ MNAT1 P51948 7/20 0.62
▸ CDK3 Q00526 1/20 0.61
▸ PIKFYVE Q9Y2I7 1/20 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
SCHEMBL16653960 1.00 MAPK8 (0.66) MAPK8MAPK9CCNKCDK12CDK7
SCHEMBL18047386 0.91 MAPK8 (0.55) MAPK8MAPK9CCNKCDK12CDK7
SCHEMBL16653990 0.91 MAPK8 (0.55) MAPK8MAPK9CCNKCDK12CDK7
SCHEMBL18047395 0.86 CDK7 (0.67) MAPK8MAPK9CCNKCDK12CDK7
SCHEMBL18047397 0.86 CDK7 (0.67) MAPK8MAPK9CCNKCDK12CDK7
SCHEMBL18047396 0.86 CDK7 (0.67) MAPK8MAPK9CCNKCDK12CDK7
SCHEMBL21397218 0.86 CDK7 (0.67) MAPK8MAPK9CCNKCDK12CDK7
SCHEMBL18047398 0.86 CDK7 (0.67) MAPK8MAPK9CCNKCDK12CDK7
SCHEMBL21397213 0.86 CDK7 (0.67) MAPK8MAPK9CCNKCDK12CDK7
SCHEMBL16653803 0.85 CDK12 (0.52) MAPK8MAPK9CCNKCDK12CDK7

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 2 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-20160264552-A1 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLFERATIVE DISEASES SYROS PHARMACEUTICALS INC (US) 2016-09-15 — — US 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 506/4885CCNK 10/4885
US-20160264552-A1 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLFERATIVE DISEASES CDK7, CDK6, CDK3 MAPK8 532/4885MAPK9 599/4885CCNK 9/4885

“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.

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