SCHEMBL10368865

SCHEMBL10368865

Oc1ccc2[nH]nc(NCCCN3CCCCC3)c2c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 6/20 0.45
▸ ACP1 P24666 3/20 0.43
▸ WNT1 P04628 3/20 0.40
▸ DYRK1A Q13627 3/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ HTR7 P34969 1/20 0.40
▸ CDC7 O00311 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ HRH2 P25021 1/20 0.39
▸ HRH1 P35367 1/20 0.39
▸ PGK1 P00558 1/20 0.39
▸ ACHE P22303 1/20 0.39

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
SCHEMBL10368034 1.00 HRH3 (0.45) HRH3ACP1WNT1DYRK1AKMT2A
SCHEMBL10370014 0.99 HRH3 (0.43) HRH3ACP1WNT1DYRK1AKMT2A
SCHEMBL10371096 0.95 ACHE (0.44) HRH3ACHE
SCHEMBL10371678 0.88 CDC7 (0.51) ACP1WNT1DYRK1AKMT2ACDC7
SCHEMBL10371460 0.87 GSK3B (0.40) DYRK1AHTR7CDC7ACHE
SCHEMBL10367631 0.86 GSK3B (0.41) DYRK1AHTR7CDC7ACHE
SCHEMBL10368910 0.86 CYP2D6 (0.45) DYRK1AKDM4EHSD17B10ACHE
SCHEMBL10371164 0.86 HRH3 (0.53) HRH3ACP1KDM4EALDH1A1LMNA
SCHEMBL10369412 0.86 HRH3 (0.53) HRH3ACP1KDM4EALDH1A1LMNA
SCHEMBL10368569 0.84 HRH3 (0.51) HRH3KDM4EALDH1A1LMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0090972-B1 INDAZOLE DERIVATIVES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1990-05-30 — — EP disclosed
US-4533731-A ANTIINFLAMMATORY AGENTS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-08-06 — — US disclosed
EP-0090972-A2 Indazole derivatives Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1983-10-12 — — EP disclosed
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