SCHEMBL17018237

SCHEMBL17018237

CC(=O)N1c2ccc(-c3cnn(CC#N)c3)cc2N(C(=O)OC(C)C)C[C@@H]1C

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 15/20 0.60
▸ PRKAB2 O43741 1/20 0.38
▸ ABL1 P00519 1/20 0.38
▸ CSF1R P07333 1/20 0.38
▸ LYN P07948 1/20 0.38
▸ TGFBR1 P36897 1/20 0.38
▸ PRKAG1 P54619 1/20 0.38
▸ SIK1 P57059 1/20 0.38
▸ PRKAA1 Q13131 1/20 0.38
▸ SIK2 Q9H0K1 1/20 0.38
▸ SIK3 Q9Y2K2 1/20 0.38
▸ BRD2 P25440 4/20 0.37

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
SCHEMBL17018257 0.92 BRD4 (0.50) BRD4PRKAB2ABL1CSF1RLYN
SCHEMBL17018247 0.92 BRD4 (0.54) BRD4PRKAB2ABL1CSF1RLYN
SCHEMBL17018276 0.92 BRD4 (0.58) BRD4BRD2
SCHEMBL16722307 0.88 BRD4 (0.61) BRD4BRD2
SCHEMBL16722043 0.88 BRD4 (0.61) BRD4PRKAB2ABL1CSF1RLYN
SCHEMBL16722042 0.88 BRD4 (0.61) BRD4PRKAB2ABL1CSF1RLYN
SCHEMBL16722309 0.88 BRD4 (0.61) BRD4BRD2
SCHEMBL16721193 0.87 BRD4 (0.55) BRD4PRKAB2ABL1CSF1RLYN
SCHEMBL17018102 0.87 BRD4 (0.61) BRD4BRD2
SCHEMBL17018097 0.87 BRD4 (0.61) BRD4PRKAB2ABL1CSF1RLYN

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-11084831-B1 Benzopiperazine compositions as BET bromodomain inhibitors FORMA THERAPEUTICS, INC. (US) 2021-08-10 — — US disclosed
US-10377769-B2 Benzopiperazine compositions as BET bromodomain inhibitors FORMA THERAPEUTICS, INC. (US) 2019-08-13 — — US disclosed
US-20160257699-A1 BENZOPIPERAZINE COMPOSITIONS AS BET BROMODOMAIN INHIBITORS FORMA THERAPEUTICS, INC. 2016-09-08 — — US disclosed
US-20160256458-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 (5 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 1/4885PRKAB2 3381/4885ABL1 1996/4885
US-20160256458-A1 BENZOPIPERAZINE COMPOSITIONS AS BET BROMODOMAIN INHIBITORS BRD4, BRPF3, BRD7 BRD4 1/4885PRKAB2 3381/4885ABL1 1996/4885
US-11084831-B1 Benzopiperazine compositions as BET bromodomain inhibitors BRD4, BRPF3, BRD7 BRD4 1/4885PRKAB2 3381/4885ABL1 1996/4885
US-10377769-B2 Benzopiperazine compositions as BET bromodomain inhibitors BRD4, BRPF3, BRD7 BRD4 1/4885PRKAB2 3381/4885ABL1 1996/4885
US-20160257699-A1 BENZOPIPERAZINE COMPOSITIONS AS BET BROMODOMAIN INHIBITORS BRD4, BRPF3, BRD7 BRD4 1/4885PRKAB2 3381/4885ABL1 1996/4885

“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