SCHEMBL28197219

SCHEMBL28197219

CCC(O)(NCc1ccccc1)c1cccs1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.40
▸ HPGD P15428 3/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ RIPK1 Q13546 1/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ CHRM3 P20309 4/20 0.37
▸ CHRM2 P08172 3/20 0.37
▸ CHRM1 P11229 3/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ RGS12 O14924 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ IDO1 P14902 1/20 0.35
▸ GLA P06280 1/20 0.35

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
SCHEMBL5915004 0.85 SMN1; SMN2 (0.43) LMNAHPGDRAB9ACHRM3CHRM2
SCHEMBL5914943 0.85 SMN1; SMN2 (0.43) LMNAHPGDRAB9ACHRM3CHRM2
SCHEMBL28197926 0.82 CHRM3 (0.40) RAB9ARIPK1MEN1KMT2ATSHR
SCHEMBL4622787 0.77 CHRM3 (0.42) RAB9ARIPK1MEN1KMT2ATSHR
SCHEMBL3264636 0.77 CHRM3 (0.42) RAB9ARIPK1MEN1KMT2ATSHR
SCHEMBL5914995 0.72 RIPK1 (0.40) RAB9ARIPK1TSHRSMN1; SMN2ALDH1A1
SCHEMBL5914941 0.72 RIPK1 (0.40) RAB9ARIPK1TSHRSMN1; SMN2ALDH1A1
SCHEMBL5915002 0.72 RIPK1 (0.40) RAB9ARIPK1TSHRSMN1; SMN2ALDH1A1
SCHEMBL5178435 0.71 KMT2A (0.44) LMNAHPGDRAB9AMEN1KMT2A
SCHEMBL1847644 0.70 RIPK1 (0.51) LMNAHPGDRAB9ARIPK1MEN1

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-107488163-A The preparation method of (2 thienyl) 1 propyl alcohol of one kind (S) 3 N, N disubstituted amidos 1 天台宜生生化科技有限公司 2017-12-19 — — CN disclosed
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