SCHEMBL28510258

SCHEMBL28510258

CNc1ccnc(Oc2cccc3c2ccn3-c2cnn(C)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TYRO3 Q06418 7/20 0.36
▸ AXL P30530 4/20 0.33
▸ MERTK Q12866 3/20 0.33
▸ SYK P43405 1/20 0.33
▸ RHEB Q15382 1/20 0.33
▸ HTR3A P46098 4/20 0.33
▸ ROCK1 Q13464 2/20 0.33
▸ LOXL2 Q9Y4K0 1/20 0.32
▸ MAP4K1 Q92918 1/20 0.32
▸ CSF1R P07333 1/20 0.32
▸ PDGFRB P09619 1/20 0.32
▸ KDR P35968 1/20 0.32
▸ IRAK4 Q9NWZ3 1/20 0.31

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
SCHEMBL28906716 0.86 LOXL2 (0.35) TYRO3SYKRHEBHTR3AROCK1
SCHEMBL28505584 0.83 GRM1 (0.41) RHEBROCK1KDR
SCHEMBL18049133 0.83 LOXL2 (0.44) ROCK1LOXL2
Hydrochloric Acid SCHEMBL28507679 0.82 GRM1 (0.41) RHEBROCK1LOXL2KDR
Hydrochloric Acid SCHEMBL18049171 0.82 LOXL2 (0.44) ROCK1LOXL2
SCHEMBL28507659 0.82 PIP4K2A (0.38) SYKROCK1
SCHEMBL28567884 0.82 LOXL2 (0.39) TYRO3AXLMERTKSYKRHEB
Hydrochloric Acid SCHEMBL28574601 0.81 LOXL2 (0.39) TYRO3AXLMERTKSYKRHEB
Hydrochloric Acid SCHEMBL28506157 0.81 PIP4K2A (0.38) SYKROCK1
SCHEMBL18361992 0.77 LOXL2 (0.38) TYRO3SYKRHEBHTR3ALOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107624110-B Lysyl oxidase-like 2 inhibitors and uses thereof 法玛克亚公司 2021-01-26 — — CN disclosed
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