SCHEMBL17962561

SCHEMBL17962561

CSc1nc(Cl)c2c(n1)CCS2

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ HSD17B10 Q99714 1/20 0.36
▸ KMT2A Q03164 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HTR2A P28223 2/20 0.31
▸ HTR2C P28335 2/20 0.31
▸ HTR2B P41595 2/20 0.31
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL590394 0.79 SMN1; SMN2 (0.37) SMN1; SMN2HSD17B10KMT2AMEN1ALDH1A1
SCHEMBL8491759 0.76 SMN1; SMN2 (0.33) SMN1; SMN2HSD17B10KMT2AMEN1ALDH1A1
SCHEMBL13176906 0.72 NPC1 (0.31) SMN1; SMN2KMT2AMEN1ALDH1A1POLB
SCHEMBL9879229 0.69 KMT2A (0.32) SMN1; SMN2KMT2A
SCHEMBL857098 0.67 KMT2A (0.46) SMN1; SMN2KMT2AMEN1ALDH1A1HTR2A
SCHEMBL14183605 0.66 HTR2A (0.35) KMT2AHTR2AHTR2CHTR2B
SCHEMBL7389179 0.64 TNKS (0.33) —
SCHEMBL22574603 0.64 KMT2A (0.38) SMN1; SMN2KMT2AMEN1ALDH1A1POLB
SCHEMBL28960187 0.62 KMT2A (0.37) KMT2AMEN1ALDH1A1POLBHTR2A
SCHEMBL75623 0.62 PDE10A (0.41) SMN1; SMN2KMT2AMEN1ALDH1A1POLB

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
CN-117510517-A Preparation method of PDE4B inhibitor BI-1015550 云南万宏医药科技有限公司 2024-02-06 — — CN claimed
CN-117510517-A Preparation method of PDE4B inhibitor BI-1015550 云南万宏医药科技有限公司 2024-02-06 — — CN disclosed
WO-2016119707-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITIONS AND METHODS HUTCHISON MEDIPHARMA LIMITED (CN) 2016-08-04 — — WO disclosed
WO-2016119707-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITIONS AND METHODS HUTCHISON MEDIPHARMA LIMITED (CN) 2016-08-04 — — WO disclosed
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