SCHEMBL15549325

SCHEMBL15549325

O=C(O)Cc1ccc2c(c1)[nH]c1ccc(Br)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.69
▸ ALDH1A1 P00352 2/20 0.69
▸ MEN1 O00255 2/20 0.69
▸ KMT2A Q03164 2/20 0.69
▸ MAPT P10636 1/20 0.69
▸ HPGD P15428 1/20 0.69
▸ HSD17B10 Q99714 1/20 0.69
▸ PPARG P37231 5/20 0.46
▸ PRNP P04156 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46
▸ NR2E3 Q9Y5X4 1/20 0.46
▸ NCOR2 Q9Y618 1/20 0.46
▸ SIRT1 Q96EB6 1/20 0.45
▸ CHUK O15111 1/20 0.44
▸ GPR17 Q13304 1/20 0.44

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
SCHEMBL31324159 0.92 KDM4E (0.81) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL31324164 0.82 MEN1 (0.69) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL1648901 0.81 KDM4E (0.74) KDM4EALDH1A1MEN1KMT2AMAPT
Methane SCHEMBL506242 0.81 MEN1 (0.67) KDM4EALDH1A1MEN1KMT2AMAPT
Carbazole SCHEMBL30528387 0.80 ALDH1A1 (0.56) KDM4EALDH1A1MEN1KMT2AMAPT
Methane SCHEMBL8206725 0.80 KDM4E (0.72) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL31324193 0.79 MEN1 (0.73) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL24440010 0.79 KDM4E (0.68) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL31324185 0.78 KDM4E (0.83) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL18938363 0.78 KDM4E (0.83) KDM4EALDH1A1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2852572-A1 CARBOLINE AND CARBAZOLE BASED IMAGING AGENTS FOR DETECTING NEUROLOGICAL DYSFUNCTION Eli Lilly and Company (US) 2015-04-01 — — EP disclosed
WO-2013176698-A1 CARBOLINE AND CARBAZOLE BASED IMAGING AGENTS FOR DETECTING NEUROLOGICAL DYSFUNCTION ELI LILLY AND COMPANY (US) 2013-11-28 — — WO disclosed
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