SCHEMBL20532149

SCHEMBL20532149

Cc1c(-c2cn(C)c(=O)cc2-c2ccccc2)cnn1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 15/20 1.00
BRD4 O60885 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP11B2 P19099 1/20 0.41
PTGS2 P35354 1/20 0.40
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL21938200 0.85 CREBBP (0.74) CREBBPBRD4PTGS2
SCHEMBL21937795 0.83 CREBBP (0.70) CREBBPBRD4PTGS2
SCHEMBL21937961 0.81 CREBBP (0.67) CREBBPBRD4PTGS2
SCHEMBL27094645 0.80 CREBBP (0.65) CREBBPBRD4HSD17B10
SCHEMBL21938111 0.79 CREBBP (0.65) CREBBPKDM4EALDH1A1
SCHEMBL12175373 0.78 CREBBP (0.62) CREBBPBRD4KDM4EALDH1A1CYP11B2
SCHEMBL20532429 0.77 CREBBP (0.63) CREBBPBRD4
SCHEMBL20532224 0.77 CREBBP (1.00) CREBBPBRD4
SCHEMBL20532171 0.76 CREBBP (0.64) CREBBPBRD4HSD17B10
SCHEMBL20532091 0.74 CREBBP (0.62) CREBBPBRD4KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10617680-B2 Therapeutic compounds CELGENE QUANTICEL RESEARCH, INC. (US) 2020-04-14 US claimed
US-20180296543-A1 THERAPEUTIC COMPOUNDS CELGENE QUANTICEL RESEARCH, INC. 2018-10-18 US claimed
US-20240293381-A1 Therapeutic Compounds CELGENE QUANTICEL RES INC (US) 2024-09-05 US disclosed
US-11890275-B2 Therapeutic compounds CELGENE QUANTICEL RESEARCH, INC. 2024-02-06 US disclosed
US-20210205284-A1 THERAPEUTIC COMPOUNDS CELGENE QUANTICEL RESEARCH, INC. (US) 2021-07-08 US disclosed
US-20210205284-A1 THERAPEUTIC COMPOUNDS CELGENE QUANTICEL RESEARCH, INC. (US) 2021-07-08 US disclosed
US-11020380-B2 Therapeutic compounds CELGENE QUANTICEL RESEARCH, INC. (US) 2021-06-01 US disclosed
US-11020380-B2 Therapeutic compounds CELGENE QUANTICEL RESEARCH, INC. (US) 2021-06-01 US disclosed
US-20200163946-A1 THERAPEUTIC COMPOUNDS CELGENE QUANTICEL RESEARCH, INC. (US) 2020-05-28 US disclosed
US-20200163946-A1 THERAPEUTIC COMPOUNDS CELGENE QUANTICEL RESEARCH, INC. (US) 2020-05-28 US disclosed
US-10617680-B2 Therapeutic compounds CELGENE QUANTICEL RESEARCH, INC. (US) 2020-04-14 US disclosed
US-10617680-B2 Therapeutic compounds CELGENE QUANTICEL RESEARCH, INC. (US) 2020-04-14 US disclosed
US-20180296543-A1 THERAPEUTIC COMPOUNDS CELGENE QUANTICEL RESEARCH, INC. 2018-10-18 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 (7 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-11020380-B2 Therapeutic compounds EP300, BRD4, BRD3 CREBBP 18/4885BRD4 2/4885KDM4E 93/4885
US-20240293381-A1 Therapeutic Compounds EP300, BRD4, BRD3 CREBBP 18/4885BRD4 2/4885KDM4E 93/4885
US-20200163946-A1 THERAPEUTIC COMPOUNDS EP300, BRD4, BRD3 CREBBP 18/4885BRD4 2/4885KDM4E 93/4885
US-20180296543-A1 THERAPEUTIC COMPOUNDS EP300, BRD4, BRD3 CREBBP 18/4885BRD4 2/4885KDM4E 93/4885
US-20210205284-A1 THERAPEUTIC COMPOUNDS EP300, BRD4, BRD3 CREBBP 18/4885BRD4 2/4885KDM4E 93/4885
US-10617680-B2 Therapeutic compounds EP300, BRD4, BRD3 CREBBP 18/4885BRD4 2/4885KDM4E 93/4885
US-11890275-B2 Therapeutic compounds EP300, BRD4, BRD3 CREBBP 18/4885BRD4 2/4885KDM4E 93/4885

“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.