SCHEMBL31590570

SCHEMBL31590570

Cc1cc(-c2cc(F)ccc2C(N)=O)n(-c2nc(C)c(C)c(=O)[nH]2)n1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ SPR P35270 10/20 0.36
▸ KDM1A O60341 1/20 0.36
▸ RCOR1 Q9UKL0 1/20 0.36
▸ SLC2A1 P11166 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ ADCY8 P40145 2/20 0.36
▸ ADCY1 Q08828 2/20 0.36
▸ BTK Q06187 2/20 0.34
▸ GLA P06280 1/20 0.34
▸ POLB P06746 1/20 0.34

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
SCHEMBL31590942 0.90 SPR (0.38) L3MBTL1SMN1; SMN2NPSR1SPRSLC2A1
SCHEMBL31590602 0.86 SPR (0.41) GAANPSR1SPRKDM1ARCOR1
SCHEMBL31590840 0.86 SLC2A1 (0.40) SPRSLC2A1ADCY8ADCY1POLB
SCHEMBL31590663 0.86 SLC2A1 (0.48) SMN1; SMN2NPSR1SPRSLC2A1ALDH1A1
SCHEMBL31590804 0.83 SPR (0.39) L3MBTL1SPRSLC2A1ALDH1A1ADCY8
SCHEMBL31590833 0.83 KDM1A (0.36) L3MBTL1GAASMN1; SMN2NPSR1SPR
SCHEMBL31590513 0.81 CFTR (0.37) L3MBTL1GAASMN1; SMN2NPSR1SPR
SCHEMBL31590631 0.81 SPR (0.38) NPSR1SPRSLC2A1ALDH1A1ADCY8
SCHEMBL31590516 0.80 SLC2A1 (0.36) L3MBTL1SPRSLC2A1ALDH1A1GLA
SCHEMBL31590943 0.79 ADCY1 (0.39) L3MBTL1SPRSLC2A1ALDH1A1ADCY8

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-120040420-A Heterocyclic-pyrazole amine derivatives, preparation method thereof and application thereof in resisting tubercle bacillus infection 中国医学科学院医药生物技术研究所 2025-05-27 — — CN disclosed
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