SCHEMBL11748575

SCHEMBL11748575

Cc1ccc(S(=O)(=O)Nc2cc3nc(-c4ccc(C(=O)Oc5ccccc5)cc4)[nH]c3cc2NS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.54
▸ HSPD1 P10809 1/20 0.52
▸ PTPN2 P17706 1/20 0.52
▸ PTPN1 P18031 1/20 0.52
▸ PTPN5 P54829 1/20 0.52
▸ HSPE1 P61604 1/20 0.52
▸ CHEK2 O96017 12/20 0.52
▸ TP53 P04637 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ RHEB Q15382 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ RAB9A P51151 1/20 0.45

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
SCHEMBL11746334 0.75 CHEK2 (0.57) CHEK2LMNASMN1; SMN2RHEBKDM4E
Hydrochloric Acid SCHEMBL11743381 0.74 CHEK2 (0.56) CHEK2LMNAKMT2ASMN1; SMN2RHEB
SCHEMBL11746348 0.74 CHEK2 (0.53) MAPTCHEK2LMNASMN1; SMN2RHEB
SCHEMBL15793163 0.72 HSPD1 (0.74) MAPTHSPD1PTPN2PTPN1PTPN5
SCHEMBL11337480 0.71 KDM4E (0.65) MAPTCHEK2TP53LMNAMEN1
SCHEMBL516310 0.70 MAPT (0.73) MAPTHSPD1PTPN2PTPN1PTPN5
SCHEMBL15793174 0.70 MAPT (0.64) MAPTHSPD1PTPN2PTPN1PTPN5
SCHEMBL27481329 0.69 TUBB4A (0.58) MAPTPTPN1LMNAMEN1KMT2A
SCHEMBL13415306 0.69 SMN1; SMN2 (0.56) MAPTKMT2ASMN1; SMN2NPC1ALDH1A1
SCHEMBL3919991 0.69 CHEK2 (0.71) MAPTHSPD1PTPN2PTPN1PTPN5

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
US-4001268-A SUBSTITUTED PHENYL-BENZIMIDAZO COMPOUNDS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 1977-01-04 — — US disclosed
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