SCHEMBL22612188

SCHEMBL22612188

Cc1nc2c(n1C)-c1nc(N)ncc1CC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ POLB P06746 1/20 0.44
▸ PIK3CD O00329 1/20 0.42
▸ PIK3R1 P27986 1/20 0.42
▸ HTT P42858 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CCNA2 P20248 6/20 0.40
▸ CDK2 P24941 6/20 0.40
▸ PIKFYVE Q9Y2I7 4/20 0.39
▸ HRH4 Q9H3N8 1/20 0.35
▸ CDK4 P11802 2/20 0.34

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) CCNA2CDK2CDK4CCND1CCND3
SCHEMBL22612194 0.82 CDK4 (0.34) CCNA2CDK2CDK4CCND1CCND3
SCHEMBL22612181 0.82 CDK4 (0.34) CCNA2CDK2CDK4CCND1CCND3
SCHEMBL21663167 0.82 CDK4 (0.50) KDM4EALDH1A1POLBPIK3CDPIK3R1
SCHEMBL24329228 0.78 KDM4E (0.45) KDM4EALDH1A1POLBPIK3CDPIK3R1
SCHEMBL1531483 0.72 CDK2 (0.57) KDM4EALDH1A1POLBPIK3CDPIK3R1
SCHEMBL24328556 0.71 KDM4E (0.42) KDM4EALDH1A1POLBPIK3CDPIK3R1
SCHEMBL24328657 0.71 KDM4E (0.42) KDM4EALDH1A1POLBPIK3CDPIK3R1
SCHEMBL22612633 0.71 ALDH1A1 (0.51) KDM4EALDH1A1POLBPIK3CDPIK3R1
SCHEMBL21662998 0.70 CDK4 (0.52) KDM4EALDH1A1POLBPIK3CDPIK3R1

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 7 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-2020223469-A1 N-(1-(METHYLSULFONYL)PIPERIDIN-4-YL)-4,5-DI HYDRO-1H-IMIDAZO[4,5-H]QUINAZOLIN-8-AMINE DERIVATIVES AND RELATED COMPOUNDS AS CYCLIN-DEPENDENT KINASE 2 (CDK2) INHIBITORS FOR TREATING CANCER 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 KDM4E 1135/4885ALDH1A1 3011/4885POLB 309/4885
US-20200347066-A1 TRICYCLIC AMINE COMPOUNDS AS CDK2 INHIBITORS CDK2, CDK1, CCNI KDM4E 965/4885ALDH1A1 4033/4885POLB 366/4885

“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.

Send feedback