SCHEMBL28883221

SCHEMBL28883221

CS(=O)(=O)[C@H]1C[C@H](NC(=O)c2nccs2)C1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
TNKS O95271 1/20 0.41
HSPA9 P38646 1/20 0.38
GRM4 Q14833 7/20 0.37
HTR3A P46098 2/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
TSHR P16473 1/20 0.35
CASP3 P42574 2/20 0.35
SENP8 Q96LD8 2/20 0.35
SENP7 Q9BQF6 2/20 0.35
SENP6 Q9GZR1 2/20 0.35
RBBP9 O75884 1/20 0.34
MGLL Q99685 1/20 0.34
MAPT P10636 1/20 0.33

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
SCHEMBL28883224 1.00 ALDH1A1 (0.42) ALDH1A1TNKSHSPA9GRM4HTR3A
SCHEMBL29529071 0.81 ALDH1A1 (0.44) ALDH1A1TNKSHSPA9GRM4HTR3A
SCHEMBL29528802 0.80 TNKS (0.42) ALDH1A1TNKSHSPA9GRM4KMT2A
SCHEMBL3620307 0.79 TNKS (0.52) ALDH1A1TNKSHSPA9KMT2AMEN1
SCHEMBL12181482 0.76 MEN1 (0.54) ALDH1A1TNKSKMT2AMEN1TSHR
SCHEMBL29528959 0.75 ALDH1A1 (0.44) ALDH1A1TNKSHSPA9GRM4HTR3A
SCHEMBL5738394 0.75 TSHR (0.60) ALDH1A1TNKSKMT2AMEN1TSHR
SCHEMBL29529436 0.72 TNKS (0.47) ALDH1A1TNKSGRM4KMT2AMEN1
SCHEMBL5774113 0.72 TNKS (0.45) ALDH1A1TNKSKMT2AMEN1TSHR
SCHEMBL28213918 0.72 ALDH1A1 (0.53) ALDH1A1HSPA9GRM4KMT2ACASP3

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-109415358-B 6-aminopyridin-3-ylthiazoles as ROR gamma t modulators 詹森药业有限公司 2022-04-05 CN disclosed