SCHEMBL11213148

SCHEMBL11213148

O=C(COc1ccc(Cc2ncc[nH]2)cc1)Nc1ccccn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 8/20 0.52
▸ NPC1 O15118 7/20 0.52
▸ TP53 P04637 3/20 0.49
▸ PKM P14618 2/20 0.49
▸ GAA P10253 2/20 0.48
▸ TAAR1 Q96RJ0 1/20 0.48
▸ MAPT P10636 2/20 0.48
▸ TSHR P16473 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ PSMB5 P28074 1/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ MITF O75030 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ XBP1 P17861 1/20 0.46
▸ SLC6A2 P23975 1/20 0.45
▸ SLC6A3 Q01959 1/20 0.45

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
SCHEMBL11207092 0.87 GAA (0.59) RAB9ANPC1PKMGAATAAR1
SCHEMBL10947493 0.82 TAAR1 (0.49) RAB9ANPC1PKMGAATAAR1
SCHEMBL11208093 0.79 NPC1 (0.62) RAB9ANPC1TP53PKMMAPT
SCHEMBL11206271 0.79 ALPL (0.46) RAB9ANPC1TP53PKMGAA
SCHEMBL11407592 0.78 NPC1 (0.57) RAB9ANPC1TP53PKMGAA
SCHEMBL10852193 0.78 TAAR1 (0.57) TAAR1MAPTSMN1; SMN2KMT2AMEN1
Hydrochloric Acid SCHEMBL7014888 0.77 GAA (0.69) RAB9ANPC1TP53PKMGAA
SCHEMBL2562542 0.77 RAB9A (0.59) RAB9ANPC1TP53PKMGAA
Hydrochloric Acid SCHEMBL10854378 0.76 TAAR1 (0.55) TAAR1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL10945831 0.76 TAAR1 (0.51) RAB9ATP53GAATAAR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0035863-B1 IMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF Pfizer Limited (GB) 1983-10-26 — — EP claimed
US-4350696-A INHIBITORS OF THROMBOXANE SYNTHETASE ENZYME PFIZER INC. (US) 1982-09-21 — — US claimed
EP-0035863-B1 IMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF Pfizer Limited (GB) 1983-10-26 — — EP disclosed
US-4350696-A INHIBITORS OF THROMBOXANE SYNTHETASE ENZYME PFIZER INC. (US) 1982-09-21 — — US disclosed
EP-0035863-A1 Imidazole derivatives, process for their preparation and pharmaceutical compositions thereof Pfizer Limited (GB) 1981-09-16 — — EP disclosed
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