SCHEMBL6419652

SCHEMBL6419652

[NH]c1noc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
LMNA P02545 1/20 0.44
CA3 P07451 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
MAOB P27338 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA13 Q8N1Q1 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
CYP3A4 P08684 1/20 0.43
BLM P54132 1/20 0.43
EPHX2 P34913 6/20 0.42

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
SCHEMBL4930668 0.73 CA12 (0.46) CA12CA1CA2LMNACA3
SCHEMBL8103815 0.73 CA12 (0.46) CA12CA1CA2LMNACA3
SCHEMBL210393 0.71 HIF1A (0.47) CA12CA1CA2LMNACA3
SCHEMBL30330201 0.71 SMN1; SMN2 (0.45) CA12CA1CA2LMNACA3
SCHEMBL29518984 0.71 CA12 (0.48) CA12CA1CA2LMNACA3
SCHEMBL1887460 0.71 CA12 (0.48) CA12CA1CA2LMNACA3
SCHEMBL468359 0.71 ESR1 (0.53) CA12CA1CA2LMNACA3
SCHEMBL2874811 0.71 CA12 (0.44) CA12CA1CA2LMNACA3
SCHEMBL445332 0.71 CA12 (0.44) CA12CA1CA2LMNACA3
SCHEMBL605706 0.71 SMN1; SMN2 (0.45) CA12CA1CA2LMNACA3

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
US-6908926-B1 Substituted imidazoles, their preparation and use NOVO NORDISK A/S (DK) 2005-06-21 US claimed
CN-117693500-A Carboxamide derivative and agricultural/horticultural plant disease control agent 组合化学工业株式会社 2024-03-12 CN disclosed
EP-0436938-B1 Silver halide color photographic material containing yellow colored cyan coupler FUJI PHOTO FILM CO LTD (JP) 1996-06-19 EP disclosed
EP-0436938-A2 Silver halide color photographic material containing yellow colored cyan coupler Fuji Photo Film Co., Ltd. (JP) 1991-07-17 EP disclosed