SCHEMBL30955865

SCHEMBL30955865

COC(=O)c1ccc2cc(NS(=O)(=O)c3cnc(-c4ccc(F)cc4)s3)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 5/20 0.47
▸ PTPN11 Q06124 1/20 0.43
▸ PLAT P00750 1/20 0.43
▸ ALPL P05186 1/20 0.42
▸ PFKFB3 Q16875 2/20 0.41
▸ PFKFB4 Q16877 2/20 0.41
▸ MEN1 O00255 6/20 0.41
▸ KMT2A Q03164 6/20 0.41
▸ CYP19A1 P11511 1/20 0.40
▸ CYP11B1 P15538 1/20 0.40
▸ CYP11B2 P19099 1/20 0.40
▸ HSPD1 P10809 1/20 0.40
▸ PTPN2 P17706 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ PTPN5 P54829 1/20 0.40
▸ HSPE1 P61604 1/20 0.40
▸ MAPT P10636 5/20 0.40
▸ LMNA P02545 4/20 0.40
▸ KDM4E B2RXH2 4/20 0.40
▸ ALDH1A1 P00352 3/20 0.40

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
SCHEMBL25072476 1.00 PLAU (0.47) PLAUPTPN11PLATALPLPFKFB3
SCHEMBL30278495 1.00 PLAU (0.47) PLAUPTPN11PLATALPLPFKFB3
SCHEMBL30278475 0.89 PTPN11 (0.46) PTPN11ALPLPFKFB3MEN1KMT2A
SCHEMBL25072449 0.89 PTPN11 (0.46) PTPN11ALPLPFKFB3MEN1KMT2A
SCHEMBL25073129 0.85 PTPN11 (0.42) PTPN11MEN1KMT2AMAPTLMNA
SCHEMBL25072742 0.82 SMN1; SMN2 (0.48) ALPLMEN1KMT2AMAPTLMNA
SCHEMBL25072756 0.80 NPY5R (0.46) PLAUALPLMEN1KMT2AMAPT
SCHEMBL25072408 0.80 PTPN11 (0.51) PTPN11MEN1KMT2APTPN1MAPT
SCHEMBL25072478 0.79 PTPN11 (0.44) PLAUPTPN11MEN1KMT2ACYP19A1
SCHEMBL25073333 0.79 KDM4E (0.47) PTPN11KMT2AMAPTLMNAKDM4E

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-118103038-A 17 Beta-hydroxysteroid dehydrogenase 13 inhibitors and methods of use thereof 英安塔制药有限公司 2024-05-28 — — CN disclosed
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