SCHEMBL6581630

SCHEMBL6581630

O=C1CCN(c2cccc(Cl)n2)N1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 16/20 0.64
▸ HTR3E A5X5Y0 3/20 0.49
▸ HTR3B O95264 3/20 0.49
▸ HTR3A P46098 3/20 0.49
▸ HTR3D Q70Z44 3/20 0.49
▸ HTR3C Q8WXA8 3/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ ALOX15 P16050 2/20 0.49
▸ G6PD P11413 1/20 0.49
▸ ALOX12 P18054 1/20 0.49
▸ PTGS1 P23219 1/20 0.49
▸ PTGS2 P35354 1/20 0.49
▸ MEN1 O00255 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ NFKB1 P19838 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ GLP1R P43220 1/20 0.40

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
SCHEMBL19062530 0.73 ALOX5 (0.64) ALOX5ALOX15G6PDALOX12PTGS1
SCHEMBL3987095 0.70 ALOX5 (1.00) ALOX5ALDH1A1ALOX15G6PDALOX12
SCHEMBL26685500 0.69 CNR2 (0.49) ALOX5HTR3EHTR3BHTR3AHTR3D
SCHEMBL3781918 0.68 ALOX5 (0.49) ALOX5HTR3EHTR3BHTR3AHTR3D
SCHEMBL5768412 0.68 ALOX5 (1.00) ALOX5ALDH1A1ALOX15G6PDALOX12
SCHEMBL31021926 0.68 ALOX5 (1.00) ALOX5ALDH1A1ALOX15G6PDALOX12
SCHEMBL2379976 0.67 ALOX5 (1.00) ALOX5HTR3EHTR3BHTR3AHTR3D
SCHEMBL27376873 0.67 ALOX5 (0.48) ALOX5HTR3EHTR3BHTR3AHTR3D
SCHEMBL29386746 0.67 ALOX5 (0.58) ALOX5ALDH1A1ALOX15G6PDALOX12
SCHEMBL28178496 0.67 ALOX5 (0.58) ALOX5ALDH1A1ALOX15G6PDALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0839138-B1 PROCESS FOR PRODUCING N-SUBSTITUTED 3-HYDROXYPYRAZOLES BASF AG (DE) 2004-05-26 — — EP disclosed
US-5922886-A Process for producing N-substituted 3-hydroxypyrazoles BASF AKTIENGESELLSCHAFT (DE) 1999-07-13 — — US disclosed
EP-0839138-A1 PROCESS FOR PRODUCING N-SUBSTITUTED 3-HYDROXYPYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 1998-05-06 — — EP disclosed
WO-1997003969-A1 PROCESS FOR PRODUCING N-SUBSTITUTED 3-HYDROXYPYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 1997-02-06 — — WO disclosed
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