SCHEMBL9808073

SCHEMBL9808073

O=C(CC(=O)NCCSc1ccc(O)cc1)NCCSc1ccc(O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 1/20 0.60
YAP1 P46937 1/20 0.60
TEAD4 Q15561 1/20 0.60
TEAD2 Q15562 1/20 0.60
ALDH1A1 P00352 4/20 0.53
LMNA P02545 1/20 0.53
HTT P42858 1/20 0.53
RAB9A P51151 3/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
NPC1 O15118 3/20 0.50
MTNR1A P48039 2/20 0.50
MTNR1B P49286 2/20 0.50
USP2 O75604 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
RECQL P46063 1/20 0.49
HPGD P15428 6/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46

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
SCHEMBL9808086 0.91 TEAD1 (0.58) TEAD1YAP1TEAD4TEAD2ALDH1A1
SCHEMBL9808287 0.89 HPGD (0.50) TEAD1YAP1TEAD4TEAD2ALDH1A1
SCHEMBL9808122 0.89 HPGD (0.57) TEAD1YAP1TEAD4TEAD2ALDH1A1
SCHEMBL9808246 0.89 ALDH1A1 (0.66) TEAD1YAP1TEAD4TEAD2ALDH1A1
SCHEMBL9808094 0.87 TEAD1 (0.53) TEAD1YAP1TEAD4TEAD2ALDH1A1
SCHEMBL9808089 0.87 TEAD1 (0.53) TEAD1YAP1TEAD4TEAD2ALDH1A1
SCHEMBL8388484 0.87 HPGD (0.56) TEAD1YAP1TEAD4TEAD2ALDH1A1
SCHEMBL21963810 0.85 MTNR1A (0.54) TEAD1YAP1TEAD4TEAD2ALDH1A1
SCHEMBL8412413 0.84 MTNR1A (0.72) TEAD1YAP1TEAD4TEAD2ALDH1A1
SCHEMBL17953394 0.82 NPC1 (0.72) TEAD1YAP1TEAD4TEAD2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4985393-A Bis/hydroxyphenylthio/ Compounds KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1991-01-15 US disclosed
EP-0373561-A2 Heat sensitive recording material KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1990-06-20 EP disclosed