SCHEMBL22920404

SCHEMBL22920404

Brc1cccc2c1C=CCC2Br

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.32
RCOR1 Q9UKL0 1/20 0.30
BRD4 O60885 1/20 0.30
GID4 Q8IVV7 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30

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
SCHEMBL22147268 0.79 GAPDH (0.30)
SCHEMBL29789778 0.79 BRD4 (0.33) KDM1ABRD4HTR2CHTR2B
SCHEMBL16302198 0.75 KDM1A (0.33) KDM1ARCOR1BRD4HTR2CHTR2B
SCHEMBL6311766 0.69 HTR2A (0.38) BRD4HTR2CHTR2B
SCHEMBL28424119 0.65 KDM1A (0.31) KDM1A
SCHEMBL968177 0.64 KDM1A (0.47) KDM1ARCOR1BRD4HTR2CHTR2B
SCHEMBL23360990 0.64 KDM1A (0.31) KDM1A
SCHEMBL1452567 0.64 KDM1A (0.32) KDM1ARCOR1HTR2CHTR2B
SCHEMBL29118170 0.64 KDM1A (0.31) KDM1A
SCHEMBL29118184 0.64 KDM1A (0.31) KDM1A

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-3166944-B1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2021-01-27 EP disclosed