SCHEMBL25258456

SCHEMBL25258456

FC(F)(F)c1cnc(NC2CCCNC2)nc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ IDH2 P48735 2/20 0.56
▸ CCNK O75909 15/20 0.52
▸ CDK12 Q9NYV4 15/20 0.52
▸ CCNT1 O60563 14/20 0.52
▸ CDK9 P50750 14/20 0.52
▸ CCNE1 P24864 13/20 0.52
▸ CDK2 P24941 13/20 0.52
▸ CDK7 P50613 3/20 0.50
▸ CCNH P51946 3/20 0.50
▸ MNAT1 P51948 3/20 0.50
▸ CHEK1 O14757 3/20 0.47

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
SCHEMBL25222649 1.00 IDH2 (0.56) IDH2CCNKCDK12CCNT1CDK9
SCHEMBL28312479 1.00 IDH2 (0.56) IDH2CCNKCDK12CCNT1CDK9
SCHEMBL28549701 0.91 IDH2 (0.54) IDH2CCNKCDK12CCNT1CDK9
SCHEMBL22895847 0.91 IDH2 (0.54) IDH2CCNKCDK12CCNT1CDK9
Hydrochloric Acid SCHEMBL28544501 0.90 IDH2 (0.53) IDH2CCNKCDK12CCNT1CDK9
Hydrochloric Acid SCHEMBL29777672 0.90 IDH2 (0.53) IDH2CCNKCDK12CCNT1CDK9
Hydrochloric Acid SCHEMBL28544495 0.90 IDH2 (0.53) IDH2CCNKCDK12CCNT1CDK9
SCHEMBL26126794 0.84 IDH2 (0.40) IDH2
SCHEMBL18607391 0.82 ULK1 (0.55) —
SCHEMBL20145185 0.82 IL1B (0.53) IDH2CCNKCDK12CCNT1CDK9

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
WO-2024063670-A1 CYCLIN-DEPENDENT KINASE 7 INHIBITORS Акционерное общество "БИОКАД" 2024-03-28 — — WO claimed
EP-4269402-A1 AROMATIC HETEROCYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF GT Apeiron Therapeutics Limited (HK) 2023-11-01 — — EP disclosed
US-20230203010-A1 BICYCLIC AMINE CDK12 INHIBITORS INCYTE CORPORATION 2023-06-29 — — US disclosed
WO-2023102184-A1 BICYCLIC AMINE COMPOUNDS AS CDK12 INHIBITORS INCYTE CORPORATION (US) 2023-06-08 — — WO disclosed
WO-2022134641-A1 AROMATIC HETEROCYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF 湃隆生物科技有限公司(香港) 2022-06-30 — — 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-20230203010-A1 BICYCLIC AMINE CDK12 INHIBITORS CDK12, CDK1, CDK2 IDH2 448/4885CCNK 17/4885CDK12 1/4885

“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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