SCHEMBL21882381

SCHEMBL21882381

Cn1cnc2c(NCc3ccco3)nc(Cl)nc21

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK1 P06493 6/20 0.67
▸ CCNE2 O96020 2/20 0.58
▸ CCNE1 P24864 2/20 0.58
▸ CDK2 P24941 2/20 0.58
▸ YTHDC1 Q96MU7 1/20 0.54
▸ ADORA3 P0DMS8 1/20 0.53
▸ ADORA2A P29274 1/20 0.53
▸ ADORA2B P29275 1/20 0.53
▸ ADORA1 P30542 1/20 0.53
▸ CCNB2 O95067 2/20 0.53
▸ CCNB1 P14635 2/20 0.53
▸ CCNB3 Q8WWL7 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ HTT P42858 1/20 0.51
▸ SHMT2 P34897 1/20 0.50
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ HPGD P15428 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ CYP1A2 P05177 1/20 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
SCHEMBL20119392 0.84 CDK1 (0.53) CDK1CDK2ADORA3ADORA2AADORA2B
SCHEMBL20119629 0.81 CDK1 (0.72) CDK1YTHDC1ADORA3ADORA2AADORA2B
SCHEMBL17933825 0.81 SMN1; SMN2 (0.58) CDK1CCNB2CCNB1CCNB3SMN1; SMN2
SCHEMBL20119375 0.80 YTHDC1 (0.62) CDK1YTHDC1ADORA3ADORA2AADORA2B
SCHEMBL6820915 0.80 ADORA3 (0.57) CDK1CCNE2CCNE1CDK2ADORA3
SCHEMBL8010398 0.80 CDK1 (1.00) CDK1CCNE2CCNE1CDK2YTHDC1
SCHEMBL20119380 0.79 HTT (0.54) CDK1YTHDC1ADORA3ADORA2AADORA2B
SCHEMBL18587976 0.77 YTHDC1 (0.59) YTHDC1ADORA3ADORA2AADORA2BADORA1
SCHEMBL29664960 0.77 YTHDC1 (0.59) YTHDC1ADORA3ADORA2AADORA2BADORA1
SCHEMBL20119336 0.77 HTT (0.52) CDK1YTHDC1ADORA3ADORA2AADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12023338-B2 Pharmaceutical composition and treatment method for genetic disease associated with splicing abnormalities KYOTO UNIVERSITY (JP) 2024-07-02 — — US disclosed
US-12023338-B2 Pharmaceutical composition and treatment method for genetic disease associated with splicing abnormalities KYOTO UNIVERSITY (JP) 2024-07-02 — — US disclosed
US-20210205314-A1 PHARMACEUTICAL COMPOSITION AND TREATMENT METHOD FOR GENETIC DISEASE ASSOCIATED WITH SPLICING ABNORMALITIES KYOTO UNIVERSITY (JP) 2021-07-08 — — US disclosed
US-20200113907-A1 PHARMACEUTICAL COMPOSITION AND TREATMENT METHOD FOR GENETIC DISEASE ASSOCIATED WITH SPLICING ABNORMALITIES KYOTO UNIVERSITY (JP) 2020-04-16 — — 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 (3 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-20210205314-A1 PHARMACEUTICAL COMPOSITION AND TREATMENT METHOD FOR GENETIC DISEASE ASSOCIATED WITH SPLICING ABNORMALITIES RBM17, SFPQ, HNRNPAB CDK1 3881/4885CCNE2 4187/4885CCNE1 4274/4885
US-12023338-B2 Pharmaceutical composition and treatment method for genetic disease associated with splicing abnormalities RBM17, SFPQ, HNRNPAB CDK1 3881/4885CCNE2 4187/4885CCNE1 4274/4885
US-20200113907-A1 PHARMACEUTICAL COMPOSITION AND TREATMENT METHOD FOR GENETIC DISEASE ASSOCIATED WITH SPLICING ABNORMALITIES RBM17, SFPQ, HNRNPAB CDK1 3881/4885CCNE2 4187/4885CCNE1 4274/4885

“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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