SCHEMBL16905973

SCHEMBL16905973

COc1ccc(CN2C(=O)COc3cc(Br)c(OC)cc32)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ FGFR1 P11362 1/20 0.40
▸ FGFR2 P21802 1/20 0.40
▸ FGFR4 P22455 1/20 0.40
▸ FGFR3 P22607 1/20 0.40
▸ POLB P06746 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ CYP2C9 P11712 3/20 0.38
▸ HTR1A P08908 3/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ CYP2D6 P10635 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ CYP1A2 P05177 2/20 0.38
▸ HTR1D P28221 2/20 0.38
▸ HTR1B P28222 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL18326362 0.90 L3MBTL1 (0.46) L3MBTL1POLBLMNATSHRCYP2C9
SCHEMBL16906152 0.84 L3MBTL1 (0.40) L3MBTL1FGFR1FGFR2FGFR4FGFR3
SCHEMBL16905841 0.84 L3MBTL1 (0.53) L3MBTL1KDM4EUSP2
SCHEMBL18317138 0.83 BRD4 (0.41) L3MBTL1FGFR1FGFR2FGFR4FGFR3
SCHEMBL16905970 0.83 TP53 (0.47) L3MBTL1POLBLMNATSHRCYP2C9
SCHEMBL16906045 0.83 L3MBTL1 (0.49) L3MBTL1POLBKDM4EUSP2MAPT
SCHEMBL20373558 0.83 L3MBTL1 (0.52) L3MBTL1POLBLMNATSHRCYP2C9
SCHEMBL18581628 0.79 L3MBTL1 (0.44) L3MBTL1POLBLMNAKDM4ECYP2C9
SCHEMBL16905987 0.79 L3MBTL1 (0.46) L3MBTL1POLBTSHRMAPTSCN9A
SCHEMBL20373353 0.79 HDAC1 (0.40) L3MBTL1POLBTSHRCYP2C9CYP3A4

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-10590118-B2 Bicyclic heterocyclic derivatives as bromodomain inhibitors ORION CORPORATION (FI) 2020-03-17 — — US disclosed
EP-3092227-B1 BICYCLIC HETEROCYCLIC DERIVATIVES AS BROMODOMAIN INHIBITORS ORION CORP (FI) 2018-07-11 — — EP disclosed
US-20160368906-A1 BICYCLIC HETEROCYCLIC DERIVATIVES AS BROMODOMAIN INHIBITORS ORION CORPORATION (FI) 2016-12-22 — — US disclosed
US-20160368906-A1 BICYCLIC HETEROCYCLIC DERIVATIVES AS BROMODOMAIN INHIBITORS ORION CORPORATION (FI) 2016-12-22 — — US disclosed
WO-2015104653-A1 BICYCLIC HETEROCYCLIC DERIVATIVES AS BROMODOMAIN INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2015-07-16 — — 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-20160368906-A1 BICYCLIC HETEROCYCLIC DERIVATIVES AS BROMODOMAIN INHIBITORS BRD1, BRD2, BRD3 L3MBTL1 2541/4885FGFR1 1466/4885FGFR2 2951/4885
US-10590118-B2 Bicyclic heterocyclic derivatives as bromodomain inhibitors BRD1, BRD2, BRD3 L3MBTL1 2541/4885FGFR1 1466/4885FGFR2 2951/4885

“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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