SCHEMBL13893901

SCHEMBL13893901

Bc1cc(Br)cc(C=O)c1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.46
▸ ERN1 O75460 2/20 0.34

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
SCHEMBL15715521 0.82 ALDH1A1 (0.36) ALDH1A1
SCHEMBL708554 0.82 ALDH1A1 (0.56) ALDH1A1ERN1
SCHEMBL646947 0.82 ALDH1A1 (0.56) ALDH1A1ERN1
SCHEMBL13861822 0.82 ALDH1A1 (0.36) ALDH1A1
SCHEMBL14515859 0.76 ALDH1A1 (0.33) ALDH1A1
SCHEMBL10065756 0.73 — —
SCHEMBL12527375 0.71 HSD17B10 (0.42) ALDH1A1ERN1
SCHEMBL19234310 0.71 ALDH1A1 (0.46) ALDH1A1ERN1
SCHEMBL21169399 0.71 ALDH1A1 (0.46) ALDH1A1ERN1
SCHEMBL1996468 0.71 ALDH1A1 (0.46) ALDH1A1ERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2197979-B1 NOVEL COMPOUND FOR ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE INCLUDING THE SAME CHEIL IND INC (KR) 2016-12-07 — — EP disclosed
EP-2239263-B1 CYCLIC COMPOUND, ITS METAL COMPLEX, AND MODIFIED METAL COMPLEX SUMITOMO CHEMICAL CO (JP) 2014-01-15 — — EP disclosed
WO-2009051454-A2 NOVEL COMPOUND FOR ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE INCLUDING THE SAME CHEIL INDUSTRIES INC. (KR) 2009-04-23 — — WO disclosed
WO-2008130524-A1 ARYL HETEROCYCLIC CGRP RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2008-10-30 — — WO disclosed
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