SCHEMBL2329752

SCHEMBL2329752

CCCCCOc1ccc(C(=O)O)cc1OC

nearest known ligand 0.97

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.74
PLA2G4B P0C869 1/20 0.72
CA12 O43570 1/20 0.67
CA1 P00915 1/20 0.67
CA2 P00918 1/20 0.67
CA4 P22748 1/20 0.67
CA6 P23280 1/20 0.67
CA7 P43166 1/20 0.67
TPMT P51580 1/20 0.67
CA9 Q16790 1/20 0.67
CA14 Q9ULX7 1/20 0.67
THRA P10827 1/20 0.66
THRB P10828 1/20 0.66
SMPD1 P17405 4/20 0.64
ALDH1A1 P00352 1/20 0.62
HPGD P15428 1/20 0.62
PTPN11 Q06124 1/20 0.60
S1PR1 P21453 2/20 0.58
S1PR3 Q99500 2/20 0.58

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
SCHEMBL18682279 0.98 PLA2G4B (0.74) TSHRPLA2G4BCA12CA1CA2
SCHEMBL29171441 0.98 PLA2G4B (0.74) TSHRPLA2G4BCA12CA1CA2
SCHEMBL29171434 0.98 PLA2G4B (0.74) TSHRPLA2G4BCA12CA1CA2
SCHEMBL7273205 0.98 PLA2G4B (0.74) TSHRPLA2G4BCA12CA1CA2
SCHEMBL16077692 0.98 PLA2G4B (0.74) TSHRPLA2G4BCA12CA1CA2
SCHEMBL9307551 0.98 PLA2G4B (0.74) TSHRPLA2G4BCA12CA1CA2
SCHEMBL2312195 0.98 PLA2G4B (0.74) TSHRPLA2G4BCA12CA1CA2
SCHEMBL29171422 0.98 PLA2G4B (0.74) TSHRPLA2G4BCA12CA1CA2
SCHEMBL1750327 0.97 TSHR (0.74) TSHRPLA2G4BCA12CA1CA2
Ethylene Glycol SCHEMBL11237315 0.94 PLA2G4B (0.70) TSHRPLA2G4BCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107011924-B Photoalignment materials with side substitution 罗利克有限公司 2021-06-01 CN disclosed
US-10738242-B2 Compound, cured product, polymer, photo-alignment film, optically anisotropic body and liquid crystal display element DIC CORPORATION (JP) 2020-08-11 US disclosed
EP-2534191-B1 PHOTOALIGNING MATERIAL WITH LATERAL SUBSTITUTION ROLIC TECH AG (CH) 2020-04-15 EP disclosed
US-9939555-B2 Cinnamic acid derivative, polymer thereof, and liquid crystal alignment layer comprising cured product thereof DIC CORPORATION (JP) 2018-04-10 US disclosed
US-9708535-B2 Liquid crystal alignment layer DIC CORPORATION (JP) 2017-07-18 US disclosed
US-20170088777-A1 LIQUID CRYSTAL ALIGNMENT LAYER DIC CORPORATION (JP) 2017-03-30 US disclosed
EP-2534191-A1 PHOTOALIGNING MATERIAL WITH LATERAL SUBSTITUTION Rolic AG (CH) 2012-12-19 EP disclosed
US-20120316317-A1 PHOTOALIGNING MATERIAL WITH LATERAL SUBSTITUTION ROLIC AG (CH) 2012-12-13 US disclosed
WO-2011098461-A1 PHOTOALIGNING MATERIAL WITH LATERAL SUBSTITUTION ROLIC AG (CH) 2011-08-18 WO disclosed
US-5459134-A Leukotriene antagonists; phospholipase, 5-alpha-reductase, and aldose reductase inhibitors ONO PHARMACEUTICAL CO., LTD. (JP) 1995-10-17 US disclosed
US-5446058-A Leukotriene antagonists, 5-alpha-reductase inhibitors ONO PHARMACEUTICAL CO., LTD. (JP) 1995-08-29 US disclosed
EP-0173516-B1 (Fused)benz(thio)amides ONO PHARMACEUTICAL CO (JP) 1993-12-01 EP disclosed
US-4939141-A (Fused) benz (thio) amides and pharmaceutical compositions, thereof ONO PHARMACEUTICAL CO., LTD. (JP) 1990-07-03 US disclosed
US-4847275-A ENZYME INHIBITOR, LEUKOTRIENE ANTAGONIST ONO PHARMACEUTICAL CO., LTD. (JP) 1989-07-11 US disclosed
US-4780469-A (Fused) benz(thio)amides and pharmaceutical use ONO PHARMACEUTICAL CO., LTD. (JP) 1988-10-25 US disclosed
EP-0173516-A2 (Fused)benz(thio)amides ONO PHARMACEUTICAL CO., LTD. (JP) 1986-03-05 EP 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 (2 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-10738242-B2 Compound, cured product, polymer, photo-alignment film, optically anisotropic body and liquid crystal display element PYM1, ZYX, CRY1 TSHR 4185/4885PLA2G4B 1428/4885CA12 1572/4885
US-20120316317-A1 PHOTOALIGNING MATERIAL WITH LATERAL SUBSTITUTION LATS1, LATS2, LCP1 TSHR 4705/4885PLA2G4B 1237/4885CA12 3886/4885

“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.