SCHEMBL9933244

SCHEMBL9933244

COC(=O)/C(CC(=O)O)=C(\c1ccc(-c2ccccc2)cc1)c1cccc(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.53
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
POLB P06746 2/20 0.52
GAA P10253 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
LMNA P02545 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ERCC5 P28715 1/20 0.46
FEN1 P39748 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
SCHEMBL9933246 1.00 TRPV1 (0.53) TRPV1KMT2AMEN1POLBGAA
SCHEMBL9899633 0.89 SMN1; SMN2 (0.47) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL9899631 0.89 SMN1; SMN2 (0.47) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL8512457 0.88 KMT2A (0.49) KMT2AMEN1POLBNPC1RAB9A
SCHEMBL8512454 0.88 KMT2A (0.49) KMT2AMEN1POLBNPC1RAB9A
SCHEMBL6555908 0.85 CES2 (0.56) KMT2AGAANPC1RAB9ASMN1; SMN2
SCHEMBL6555910 0.85 CES2 (0.56) KMT2AGAANPC1RAB9ASMN1; SMN2
SCHEMBL7814737 0.84 NPC1 (0.57) KMT2AMEN1POLBNPC1RAB9A
SCHEMBL7814739 0.84 NPC1 (0.57) KMT2AMEN1POLBNPC1RAB9A
SCHEMBL1011068 0.84 SMN1; SMN2 (0.54) KMT2AMEN1GAANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651914-B1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL INC (US) 2015-05-13 EP disclosed
US-8920928-B2 Photochromic compounds and compositions TRANSITIONS OPTICAL, INC. (US) 2014-12-30 US disclosed
US-20120156508-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120156508-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS CRY2, CRY1, IPO4 TRPV1 1204/4885KMT2A 2088/4885MEN1 3275/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.