SCHEMBL27095987

SCHEMBL27095987

CN1CCC(COc2cc(CNc3ccc4cnccc4c3)ccn2)CC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 13/20 0.42
CDK9 P50750 13/20 0.42
APAF1 O14727 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
IKBKB O14920 1/20 0.37
CHUK O15111 1/20 0.37
KDM5A P29375 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
JAK2 O60674 1/20 0.37
ROCK2 O75116 1/20 0.37
JAK3 P52333 1/20 0.37
ROCK1 Q13464 1/20 0.37
EGFR P00533 1/20 0.36

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
SCHEMBL24493330 0.89 CCNT1 (0.39) CCNT1CDK9APAF1CASP3SENP8
SCHEMBL30578277 0.89 CCNT1 (0.39) CCNT1CDK9APAF1CASP3SENP8
SCHEMBL24493331 0.89 CCNT1 (0.39) CCNT1CDK9APAF1CASP3SENP8
SCHEMBL24493315 0.84 MRGPRX1 (0.47) CCNT1CDK9ROCK2ROCK1
SCHEMBL30578216 0.84 MRGPRX1 (0.47) CCNT1CDK9ROCK2ROCK1
SCHEMBL24493569 0.79 KDR (0.39) CCNT1CDK9EGFR
SCHEMBL29119690 0.79 GRM4 (0.41) CCNT1CDK9
SCHEMBL30578248 0.79 KDR (0.39) CCNT1CDK9EGFR
SCHEMBL29650050 0.79 KDR (0.39) CCNT1CDK9EGFR
SCHEMBL24493583 0.78 HRH3 (0.40) APAF1CASP3SENP8SENP7SENP6

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
US-20240059691-A1 ENZYME INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2024-02-22 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 (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-20240059691-A1 ENZYME INHIBITORS SERPINB1, XDH, ACE CCNT1 644/4885CDK9 499/4885APAF1 919/4885

“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.