SCHEMBL17018261

SCHEMBL17018261

COC(=O)N1c2ccc(-c3cnn(CCN(C)C)c3)cc2N(C(=O)OC(C)C)C[C@@H]1C

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 10/20 0.49
▸ TGFBR1 P36897 4/20 0.39
▸ NAMPT P43490 1/20 0.37
▸ PAICS P22234 1/20 0.37
▸ TTK P33981 2/20 0.37
▸ CREBBP Q92793 4/20 0.36
▸ FGFR1 P11362 1/20 0.35
▸ MAP4K4 O95819 2/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ NEK2 P51955 1/20 0.35

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
SCHEMBL16722069 0.92 BRD4 (0.59) BRD4TGFBR1CREBBPFGFR1FLT3
SCHEMBL16722067 0.92 BRD4 (0.59) BRD4TGFBR1CREBBPFGFR1FLT3
SCHEMBL17018118 0.91 BRD4 (0.52) BRD4NAMPTCREBBP
SCHEMBL17018264 0.91 BRD4 (0.53) BRD4TGFBR1NAMPTCREBBPFLT3
SCHEMBL17018117 0.90 BRD4 (0.51) BRD4TGFBR1NAMPTTTK
SCHEMBL17018266 0.88 BRD4 (0.49) BRD4NAMPT
SCHEMBL17018115 0.88 BRD4 (0.49) BRD4FLT3
SCHEMBL17018112 0.88 BRD4 (0.55) BRD4NAMPTCREBBP
SCHEMBL16722066 0.87 BRD4 (0.51) BRD4NAMPTCREBBP
SCHEMBL17018120 0.86 BRD4 (0.51) BRD4NAMPTTTKCREBBPFGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10377769-B2 Benzopiperazine compositions as BET bromodomain inhibitors FORMA THERAPEUTICS, INC. (US) 2019-08-13 — — US disclosed
US-20160256458-A1 BENZOPIPERAZINE COMPOSITIONS AS BET BROMODOMAIN INHIBITORS FORMA THERAPEUTICS, INC. 2016-09-08 — — US disclosed
US-20160257699-A1 BENZOPIPERAZINE COMPOSITIONS AS BET BROMODOMAIN INHIBITORS FORMA THERAPEUTICS, INC. 2016-09-08 — — US disclosed
US-9422281-B2 Benzopiperazine compositions as BET bromodomain inhibitors FORMA THERAPEUTICS, INC. (US) 2016-08-23 — — US disclosed
US-20150232465-A1 BENZOPIPERAZINE COMPOSITIONS AS BET BROMODOMAIN INHIBITORS FORMA THERAPEUTICS, INC. 2015-08-20 — — 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 (4 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-20150232465-A1 BENZOPIPERAZINE COMPOSITIONS AS BET BROMODOMAIN INHIBITORS BRD4, BRPF3, BRD7 BRD4 1/4885TGFBR1 1868/4885NAMPT 2915/4885
US-20160256458-A1 BENZOPIPERAZINE COMPOSITIONS AS BET BROMODOMAIN INHIBITORS BRD4, BRPF3, BRD7 BRD4 1/4885TGFBR1 1868/4885NAMPT 2915/4885
US-10377769-B2 Benzopiperazine compositions as BET bromodomain inhibitors BRD4, BRPF3, BRD7 BRD4 1/4885TGFBR1 1868/4885NAMPT 2915/4885
US-20160257699-A1 BENZOPIPERAZINE COMPOSITIONS AS BET BROMODOMAIN INHIBITORS BRD4, BRPF3, BRD7 BRD4 1/4885TGFBR1 1868/4885NAMPT 2915/4885

“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