SCHEMBL31590765

SCHEMBL31590765

Cc1cc(NC(=O)c2sccc2Cl)n(-c2nc(C)c(C)c(=O)[nH]2)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.58
▸ KMT2A Q03164 5/20 0.58
▸ MAPT P10636 4/20 0.58
▸ NPSR1 Q6W5P4 4/20 0.58
▸ TDP1 Q9NUW8 3/20 0.58
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ LMNA P02545 1/20 0.58
▸ MAPK1 P28482 1/20 0.58
▸ ATM Q13315 1/20 0.58
▸ HTT P42858 4/20 0.50
▸ POLB P06746 2/20 0.49
▸ SLC2A1 P11166 2/20 0.48
▸ CFTR P13569 2/20 0.47
▸ ALDH1A1 P00352 4/20 0.47
▸ ADCY1 Q08828 6/20 0.46
▸ ADCY8 P40145 4/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ HPGD P15428 2/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ KDM1A O60341 1/20 0.44

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
SCHEMBL31590776 0.82 ADCY1 (0.55) MEN1KMT2AMAPTNPSR1TDP1
SCHEMBL23249474 0.80 ADCY1 (0.52) MEN1KMT2AMAPTNPSR1TDP1
SCHEMBL31590957 0.78 ADCY1 (0.52) MEN1KMT2AMAPTNPSR1TDP1
SCHEMBL31590750 0.77 MAPT (0.50) MEN1KMT2AMAPTNPSR1TDP1
SCHEMBL31591016 0.77 KMT2A (0.58) MEN1KMT2AMAPTNPSR1SLC2A1
SCHEMBL31590897 0.76 ADCY1 (0.55) MEN1KMT2AMAPTNPSR1TDP1
SCHEMBL31591054 0.76 SLC2A1 (0.45) MEN1KMT2AMAPTNPSR1SMN1; SMN2
SCHEMBL31590900 0.74 KCNJ6 (0.62) MEN1KMT2AMAPTNPSR1LMNA
SCHEMBL31590599 0.74 ADCY8 (0.51) TDP1SLC2A1ADCY1ADCY8KDM4E
SCHEMBL31590680 0.73 SLC2A1 (0.46) SLC2A1CFTRALDH1A1ADCY1ADCY8

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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