SCHEMBL5763166

SCHEMBL5763166

Oc1ccc2cccc(Br)c2n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.59
KMT2A Q03164 3/20 0.42
HSP90AA1 P07900 3/20 0.42
RAB9A P51151 3/20 0.42
MEN1 O00255 2/20 0.42
NPC1 O15118 2/20 0.42
AR P10275 1/20 0.40
METAP2 P50579 2/20 0.39
PLAU P00749 1/20 0.39
NCF1 P14598 1/20 0.39
NQO2 P16083 2/20 0.38
CYP3A4 P08684 2/20 0.38
HIF1A Q16665 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
ALOX12 P18054 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL339928 0.77 BACE1 (0.63) BACE1KMT2AHSP90AA1RAB9AMEN1
SCHEMBL30657716 0.77 BACE1 (0.63) BACE1KMT2AHSP90AA1RAB9AMEN1
SCHEMBL672744 0.77 METAP2 (0.63) KMT2AHSP90AA1RAB9AMEN1NPC1
SCHEMBL30082244 0.77 METAP2 (0.63) KMT2AHSP90AA1RAB9AMEN1NPC1
SCHEMBL7983249 0.77 BACE1 (0.56) BACE1RAB9ANPC1ARNQO2
SCHEMBL8467827 0.76 METAP2 (0.61) KMT2AHSP90AA1RAB9AMEN1NPC1
SCHEMBL413180 0.76 METAP2 (0.61) KMT2AHSP90AA1RAB9AMEN1NPC1
SCHEMBL16444064 0.76 METAP2 (0.61) KMT2AHSP90AA1RAB9AMEN1NPC1
Ammonia Solution, Strong SCHEMBL3284067 0.76 METAP2 (0.61) KMT2AHSP90AA1RAB9AMEN1NPC1
SCHEMBL6540982 0.76 METAP2 (0.61) KMT2AHSP90AA1RAB9AMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119241559-A Quinazoline macrocyclic compound serving as HPK1 kinase inhibitor and preparation method and application thereof 深圳市新樾生物科技有限公司 2025-01-03 CN disclosed
CN-101289442-A Novel benzoimidazole derivatives useful as antiproliferative agents PFIZER PROD INC (US) 2008-10-22 CN disclosed
US-7019147-B1 Benzimidazole derivatives useful as antiproliferative agents PFIZER INC. (US) 2006-03-28 US disclosed
EP-1235825-B1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS PFIZER PROD INC (US) 2006-01-25 EP disclosed
CN-1402721-A Novel benzimidazole derivatives as antiproliferative agents PFIZER PROD INC (US) 2003-03-12 CN disclosed
EP-1235825-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS Pfizer Products Inc. (US) 2002-09-04 EP disclosed
WO-2001040217-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS PFIZER PRODUCTS INC. (US) 2001-06-07 WO disclosed