SCHEMBL30865698

SCHEMBL30865698

O=S(=O)(c1ccccc1)n1cc(-c2nc(NC3CCCNC3)ncc2C(F)(F)F)c2ccc(Cl)nc21

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDK7 P50613 12/20 0.59
CCNH P51946 12/20 0.59
MNAT1 P51948 10/20 0.59
CCNK O75909 14/20 0.55
CDK12 Q9NYV4 14/20 0.55
CCNT1 O60563 13/20 0.55
CDK9 P50750 13/20 0.55
CCNE1 P24864 12/20 0.55
CDK2 P24941 12/20 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
SCHEMBL29083547 0.85 MAPK3 (0.46) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL29083562 0.85 MAPK3 (0.46) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL30439287 0.82 CCNK (0.65) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL25596320 0.81 CCNK (0.66) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL24583253 0.81 CDK7 (0.43) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL16664896 0.78 CCNT1 (0.74) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL30440015 0.78 CCNT1 (0.74) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL29394684 0.78 CCNT1 (0.74) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL30886754 0.78 CCNT1 (0.74) CDK7CCNHMNAT1CCNKCDK12
SCHEMBL16655161 0.78 CCNT1 (0.74) CDK7CCNHMNAT1CCNKCDK12

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-12540149-B2 Aromatic heterocyclic compound, pharmaceutical composition, and use thereof RECURSION PHARMACEUTICALS, INC. (US) 2026-02-03 US disclosed
US-20240132489-A1 AROMATIC HETEROCYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION, AND USE THEREOF EXSCIENTIA AI LIMITED (GB) 2024-04-25 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-20240132489-A1 AROMATIC HETEROCYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION, AND USE THEREOF CDK7, CDK17, CDK8 CDK7 1/4885CCNH 51/4885MNAT1 212/4885
US-12540149-B2 Aromatic heterocyclic compound, pharmaceutical composition, and use thereof CDK7, CDK17, CDK1 CDK7 1/4885CCNH 63/4885MNAT1 289/4885

“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.