SCHEMBL2567988

SCHEMBL2567988

CCCCCCC1CCC(C(F)(F)Oc2ccc(/C=C/C(=O)O)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ SENP8 Q96LD8 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ ESR1 P03372 6/20 0.37
▸ ESR2 Q92731 4/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.36
▸ ABCG2 Q9UNQ0 1/20 0.36
▸ CYP1A1 P04798 2/20 0.36
▸ CYP1B1 Q16678 2/20 0.36
▸ LSS P48449 2/20 0.36
▸ EGFR P00533 1/20 0.36

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
SCHEMBL2567989 1.00 THRB (0.41) THRBATMKDM4ENPC1ALDH1A1
SCHEMBL2567585 0.99 THRB (0.42) THRBATMKDM4ENPC1ALDH1A1
SCHEMBL2567584 0.99 THRB (0.42) THRBATMKDM4ENPC1ALDH1A1
SCHEMBL2564311 0.96 THRB (0.43) THRBATMKDM4ENPC1ALDH1A1
SCHEMBL2564308 0.96 THRB (0.43) THRBATMKDM4ENPC1ALDH1A1
SCHEMBL2565287 0.91 THRB (0.45) THRBATMKDM4EALDH1A1SMN1; SMN2
SCHEMBL2565290 0.91 THRB (0.45) THRBATMKDM4EALDH1A1SMN1; SMN2
SCHEMBL14674296 0.88 THRB (0.41) THRBATMESR1ESR2HRH3
SCHEMBL14674295 0.88 THRB (0.41) THRBATMESR1ESR2HRH3
SCHEMBL14674785 0.88 THRB (0.38) THRBATMKDM4ENPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9097938-B2 Photoaligning material ROLIC AG (CH) 2015-08-04 — — US disclosed
EP-2561007-A1 PHOTOALIGNING MATERIAL Rolic AG (CH) 2013-02-27 — — EP disclosed
US-20130035446-A1 PHOTOALIGNING MATERIAL ROLIC AG (CH) 2013-02-07 — — US disclosed
WO-2011131649-A1 PHOTOALIGNING MATERIAL ROLIC AG (CH) 2011-10-27 — — WO 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-20130035446-A1 PHOTOALIGNING MATERIAL MAP1LC3C, MAP1LC3A, LCP1 THRB 4824/4885ATM 2058/4885KDM4E 4633/4885

“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.

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