SCHEMBL29897733

SCHEMBL29897733

Brc1ccc2c([nH]c3ccccc32)c1Br

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 6/20 0.55
GABRP O00591 2/20 0.53
GABRD O14764 2/20 0.53
GABRA1 P14867 2/20 0.53
GABRB1 P18505 2/20 0.53
GABRG2 P18507 2/20 0.53
GABRB3 P28472 2/20 0.53
GABRA5 P31644 2/20 0.53
GABRA3 P34903 2/20 0.53
GABRA2 P47869 2/20 0.53
GABRB2 P47870 2/20 0.53
GABRA4 P48169 2/20 0.53
GABRE P78334 2/20 0.53
GABRA6 Q16445 2/20 0.53
GABRG1 Q8N1C3 2/20 0.53
GABRG3 Q99928 2/20 0.53
GABRQ Q9UN88 2/20 0.53
ALDH1A1 P00352 3/20 0.50
HSD17B10 Q99714 3/20 0.50
GPR3 P46089 2/20 0.50

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
SCHEMBL409752 1.00 KIF11 (0.55) KIF11GABRPGABRDGABRA1GABRB1
Benzoic Acid SCHEMBL31179913 0.86 MPL (0.46) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL23702738 0.81 KIF11 (0.52) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL18457735 0.81 KIF11 (0.61) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL17094777 0.81 AR (0.58) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL13563976 0.80 KIF11 (0.78) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL191347 0.80 KIF11 (0.71) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL29378455 0.80 KIF11 (0.71) KIF11GABRPGABRDGABRA1GABRB1
Methyl Benzoate SCHEMBL31179910 0.80 KIF11 (0.56) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL22136407 0.80 KIF11 (0.60) KIF11GABRPGABRDGABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250255087-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2025-08-07 US disclosed
CN-118772042-A Organic hole transport material, application thereof and perovskite solar cell 嘉庚创新实验室 2024-10-15 CN disclosed
CN-110698501-B Transition metal complex and application thereof 广州华睿光电材料有限公司 2022-10-04 CN disclosed