SCHEMBL9929431

SCHEMBL9929431

CCCCOc1ccc(C2(c3ccc(OC)cc3)C=Cc3c4c(c5ccccc5c3O2)-c2ccccc2C4(C)C)cc1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PDK2 Q15119 2/20 0.31
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
HTT P42858 1/20 0.30
PGR P06401 1/20 0.30

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
SCHEMBL29664189 1.00 RECQL (0.33) RECQLALDH1A1LMNACYP2C9CYP2C19
SCHEMBL15954429 0.94 ALDH1A1 (0.32) RECQLALDH1A1LMNACYP2C9CYP2C19
SCHEMBL10102320 0.93 NPSR1 (0.31) ALDH1A1LMNACYP2C9CYP2C19NPSR1
SCHEMBL25604056 0.92 CYP2C9 (0.38) RECQLLMNACYP2C9CYP2C19NPSR1
SCHEMBL2371469 0.92 ALK (0.32) RECQLPDK2HTT
SCHEMBL1680041 0.92 PGR (0.34) ALDH1A1LMNACYP2C9CYP2C19HPGD
SCHEMBL29664183 0.92 PGR (0.34) ALDH1A1LMNACYP2C9CYP2C19HPGD
SCHEMBL9900319 0.90 GAA (0.33) CYP2C9CYP2C19PDK2MAPTHPGD
SCHEMBL3147233 0.90 PGR (0.33) ALDH1A1LMNACYP2C9CYP2C19MAPT
SCHEMBL25716071 0.90 HTT (0.32) LMNAL3MBTL1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651912-B1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL INC (US) 2018-10-03 EP disclosed
US-9034219-B2 Photochromic compounds and compositions TRANSITIONS OPTICAL, INC. (US) 2015-05-19 US disclosed
US-9034219-B2 Photochromic compounds and compositions TRANSITIONS OPTICAL, INC. (US) 2015-05-19 US disclosed
US-9034219-B2 Photochromic compounds and compositions TRANSITIONS OPTICAL, INC. (US) 2015-05-19 US disclosed
US-8308995-B2 Chromene compound TOKUYAMA CORPORATION (JP) 2012-11-13 US disclosed
US-20120156521-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 US disclosed
US-20120156521-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 US disclosed
US-20120156521-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 US disclosed
US-20120138876-A1 CHROMENE COMPOUND KASAI SOKO (JP) 2012-06-07 US disclosed
US-8147726-B2 Chromene compound TOKUYAMA CORPORATION (JP) 2012-04-03 US disclosed
US-20110062396-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2011-03-17 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 (3 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-20120156521-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS CRY2, CRY1, PPOX RECQL 175/4885ALDH1A1 1243/4885LMNA 657/4885
US-20120138876-A1 CHROMENE COMPOUND CHRM1, CBX8, CBX7 RECQL 699/4885ALDH1A1 1382/4885LMNA 602/4885
US-20110062396-A1 CHROMENE COMPOUND CDYL, NR0B1, NR1H2 RECQL 1484/4885ALDH1A1 1987/4885LMNA 636/4885

“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.