SCHEMBL9869650

SCHEMBL9869650

Fc1cccc(NC=S)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
IDO1 P14902 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 3/20 0.43
GAA P10253 3/20 0.43
HTT P42858 1/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
RAPGEF4 Q8WZA2 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
ALDH1A1 P00352 2/20 0.42
CA12 O43570 1/20 0.42
MMP2 P08253 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL13039534 0.78 ALDH1A1 (0.54) KDM4EIDO1MEN1KMT2AMAPT
SCHEMBL27908152 0.78 KDM4E (0.47) KDM4EIDO1MEN1KMT2AMAPT
SCHEMBL1189639 0.78 ALDH1A1 (0.54) KDM4EIDO1MEN1KMT2AMAPT
SCHEMBL1172409 0.74 MAPT (0.52) MEN1KMT2AMAPTGAAHTT
SCHEMBL3378202 0.74 MAPT (0.48) IDO1MEN1KMT2AMAPTGAA
SCHEMBL30675253 0.74 RAPGEF4 (0.61) IDO1MEN1KMT2AMAPTNPC1
SCHEMBL392473 0.74 RAPGEF4 (0.61) IDO1MEN1KMT2AMAPTNPC1
SCHEMBL9870952 0.74 MEN1 (0.55) KDM4EIDO1MEN1KMT2AMAPT
SCHEMBL5901382 0.74 MEN1 (0.46) KDM4EIDO1MEN1KMT2AMAPT
SCHEMBL3483051 0.72 ALDH1A1 (0.40) KDM4EIDO1MEN1KMT2AMAPT

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5025034-A Thromboxane inhibitors NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1991-06-18 US claimed
US-4945106-A Prostaglandins NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1990-07-31 US claimed
US-4596823-A Prostaglandins NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1986-06-24 US claimed
EP-0043292-B1 PROSTAGLANDINS NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1986-01-15 EP claimed
CN-108699053-B 4-hydroxy-2-phenyl-1, 3-thiazol-5-yl methanone derivatives as TRPM8 antagonists 东佩制药股份公司 2022-01-14 CN disclosed
CN-108699053-A 4- hydroxyl -2- phenyl -1,3- thiazole -5- base ketone derivatives as TRPM8 antagonists 东佩制药股份公司 2018-10-23 CN disclosed
CN-106660975-A 2-aryl-4-hydroxy-1, 3-thiazole derivatives as TRPM 8-inhibitors for the treatment of neuralgia, pain, COPD and asthma 东佩制药股份公司 2017-05-10 CN disclosed