SCHEMBL22612181

SCHEMBL22612181

Cc1nc2c(n1C)-c1nc(Br)ncc1CC2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 5/20 0.34
▸ CCND1 P24385 3/20 0.34
▸ CDK2 P24941 11/20 0.32
▸ CCNA2 P20248 9/20 0.32
▸ IGF1R P08069 8/20 0.32
▸ CCNA1 P78396 8/20 0.32
▸ AURKA O14965 4/20 0.32
▸ CCND3 P30281 2/20 0.32
▸ CDK6 Q00534 2/20 0.32
▸ CCNT1 O60563 2/20 0.32
▸ CDK1 P06493 2/20 0.32
▸ CCNB1 P14635 2/20 0.32
▸ CCNE1 P24864 2/20 0.32
▸ CDK7 P50613 2/20 0.32
▸ CDK9 P50750 2/20 0.32
▸ CCNH P51946 2/20 0.32
▸ PLK1 P53350 3/20 0.31
▸ TTK P33981 2/20 0.31
▸ PLK3 Q9H4B4 2/20 0.31
▸ PLK2 Q9NYY3 2/20 0.31

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
SCHEMBL22619419 0.85 CDK4 (0.35) CDK4CCND1CDK2CCNA2IGF1R
SCHEMBL22612188 0.82 KDM4E (0.44) CDK4CCND1CDK2CCNA2CCNA1
SCHEMBL22612194 0.82 CDK4 (0.34) CDK4CCND1CDK2CCNA2IGF1R
SCHEMBL22612617 0.72 CDK2 (0.48) CDK4CCND1CDK2CCNA2CCNA1
SCHEMBL22619433 0.71 CDK2 (0.49) CDK4CCND1CDK2CCNA2IGF1R
SCHEMBL22612198 0.69 CDK2 (0.50) CDK4CCND1CDK2CCNA2IGF1R
SCHEMBL22619432 0.69 CDK2 (0.49) CDK4CCND1CDK2CCNA2IGF1R
SCHEMBL22624289 0.69 CDK2 (0.48) CDK4CCND1CDK2CCNA2CCNA1
SCHEMBL21663167 0.65 CDK4 (0.50) CDK4CCND1CDK2CCNA2CCNA1
SCHEMBL24329228 0.60 KDM4E (0.45) CDK2CCNA2CCNA1PLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11447494-B2 Tricyclic amine compounds as CDK2 inhibitors INCYTE CORPORATION (US) 2022-09-20 — — US disclosed
US-11447494-B2 Tricyclic amine compounds as CDK2 inhibitors INCYTE CORPORATION (US) 2022-09-20 — — US disclosed
US-20200347066-A1 TRICYCLIC AMINE COMPOUNDS AS CDK2 INHIBITORS INCYTE CORPORATION 2020-11-05 — — US disclosed
US-20200347066-A1 TRICYCLIC AMINE COMPOUNDS AS CDK2 INHIBITORS INCYTE CORPORATION 2020-11-05 — — US disclosed
WO-2020223558-A1 TRICYCLIC AMINE COMPOUNDS AS CDK2 INHIBITORS INCYTE CORPORATION (US) 2020-11-05 — — WO disclosed
WO-2020223558-A1 TRICYCLIC AMINE COMPOUNDS AS CDK2 INHIBITORS INCYTE CORPORATION (US) 2020-11-05 — — 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-11447494-B2 Tricyclic amine compounds as CDK2 inhibitors CDK2, CDK1, CCNI CDK4 12/4885CCND1 47/4885CDK2 1/4885
US-20200347066-A1 TRICYCLIC AMINE COMPOUNDS AS CDK2 INHIBITORS CDK2, CDK1, CCNI CDK4 8/4885CCND1 53/4885CDK2 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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