SCHEMBL24366160

SCHEMBL24366160

C=CCCn1cc(-c2cc(CO)cc3c2ncn3C)c2cc[nH]c2c1=O

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CECR2 Q9BXF3 19/20 0.67
TAF1 P21675 17/20 0.67
BRD9 Q9H8M2 17/20 0.67
BRD4 O60885 17/20 0.67
TAF11 Q15544 1/20 0.67
TAF1L Q8IZX4 1/20 0.67

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
SCHEMBL19640307 0.87 CECR2 (0.76) CECR2TAF1BRD9BRD4TAF11
SCHEMBL27401699 0.82 CECR2 (0.86) CECR2TAF1BRD9BRD4TAF11
SCHEMBL29666958 0.81 CECR2 (1.00) CECR2TAF1BRD9BRD4TAF11
SCHEMBL17749835 0.81 CECR2 (1.00) CECR2TAF1BRD9BRD4TAF11
SCHEMBL17749793 0.75 TAF1 (1.00) CECR2TAF1BRD9BRD4TAF11
SCHEMBL24363707 0.73 CECR2 (0.64) CECR2TAF1BRD9BRD4TAF11
SCHEMBL17758551 0.72 CECR2 (0.81) CECR2TAF1BRD9BRD4TAF11
SCHEMBL24364411 0.71 CECR2 (0.79) CECR2TAF1BRD9BRD4TAF11
SCHEMBL17749765 0.71 CECR2 (1.00) CECR2TAF1BRD9BRD4TAF11
SCHEMBL27401702 0.71 BRD9 (0.69) CECR2TAF1BRD9BRD4TAF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3218375-B1 SUBSTITUTED PYRROLOPYRDINES AS INHIBITORS OF BROMODOMAIN GENENTECH INC (US) 2022-04-27 EP disclosed