SCHEMBL9942427

SCHEMBL9942427

CC(C)(C)N1CCCC(Cn2ncc3c([N+](=O)[O-])cccc32)C1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MCOLN3 Q8TDD5 1/20 0.33
CYP19A1 P11511 3/20 0.33
MAPT P10636 1/20 0.32
LMNA P02545 1/20 0.32
GRM2 Q14416 1/20 0.32
HTT P42858 1/20 0.32
CTSB P07858 1/20 0.32
SSTR4 P31391 1/20 0.32

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
SCHEMBL9938796 0.83 BRD4 (0.41) KMT2AMEN1MAPTHTT
SCHEMBL15312796 0.82 HTR6 (0.43) CYP2C9
SCHEMBL27940167 0.82 MAPT (0.35) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL15312700 0.82 BTK (0.39) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL27940202 0.81 KMT2A (0.41) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL27227914 0.81 GRM2 (0.42) CYP1A2CYP2D6CYP2C9CYP2C19ALDH1A1
SCHEMBL30860962 0.81 GRM2 (0.42) CYP1A2CYP2D6CYP2C9CYP2C19ALDH1A1
SCHEMBL9939246 0.81 CYP1A2 (0.41) CYP1A2CYP2D6CYP2C9CYP2C19ALDH1A1
SCHEMBL9941478 0.77 MERTK (0.39)
SCHEMBL27228062 0.76 TDP1 (0.39) KMT2AMEN1CYP1A2CYP2D6CYP2C9

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-2651939-A1 SUBSTITUTED N-(1H-INDAZOL-4-YL)IMIDAZO[1,2-a]PYRIDINE-3-CARBOXAMIDE COMPOUNDS AS TYPE III RECEPTOR TYROSINE KINASE INHIBITORS Array Biopharma, Inc. (US) 2013-10-23 EP disclosed
WO-2012082689-A1 SUBSTITUTED N-(1H-INDAZOL-4-YL)IMIDAZO[1,2-a]PYRIDINE-3-CARBOXAMIDE COMPOUNDS AS TYPE III RECEPTOR TYROSINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2012-06-21 WO disclosed