SCHEMBL16923005

SCHEMBL16923005

COc1cc(COCC2CO2)ccc1OCC1CO1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 8/20 0.46
ALDH1A1 P00352 2/20 0.45
GLA P06280 1/20 0.45
CA2 P00918 3/20 0.41
TSHR P16473 2/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HIF1A Q16665 1/20 0.41
CA1 P00915 2/20 0.40
CA9 Q16790 2/20 0.40
CA12 O43570 1/20 0.40
DRD2 P14416 1/20 0.40
ADRA2C P18825 1/20 0.40
HTT P42858 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
ABCB1 P08183 1/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL6631330 0.93 CA2 (0.49) DRD4ALDH1A1CA2TSHRCYP3A4
SCHEMBL21023624 0.92 DRD4 (0.44) DRD4ALDH1A1GLACA2TSHR
SCHEMBL24146971 0.88 DRD4 (0.42) DRD4ALDH1A1GLATSHRTP53
SCHEMBL14141498 0.85 ALDH1A1 (0.47) DRD4ALDH1A1GLACA2TSHR
SCHEMBL9859375 0.85 ALDH1A1 (0.47) DRD4ALDH1A1GLACA2TSHR
SCHEMBL24412751 0.85 ALDH1A1 (0.40) DRD4ALDH1A1GLATSHRTP53
SCHEMBL24412749 0.84 MEN1 (0.44) DRD4ALDH1A1GLASMN1; SMN2HIF1A
SCHEMBL21680113 0.84 NPC1 (0.49) DRD4ALDH1A1GLACA2TSHR
SCHEMBL22493504 0.84 HIF1A (0.43) DRD4ALDH1A1GLATSHRSMN1; SMN2
SCHEMBL11590752 0.83 NPC1 (0.50) DRD4ALDH1A1GLASMN1; SMN2HIF1A

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116554196-A Bio-based thermosetting epoxy resin curing agent and preparation method and application thereof 中国科学院山西煤炭化学研究所 2023-08-08 CN claimed
CN-114525072-A Polyethers containing cyclic groups other than bisphenols 宣伟投资管理有限公司 2022-05-24 CN claimed
US-20200317953-A1 POLYETHERS CONTAINING NON-BISPHENOLIC CYCLIC GROUPS SWIMC LLC (US) 2020-10-08 US claimed
EP-3146009-A1 POLYETHERS CONTAINING NON-BISPHENOLIC CYCLIC GROUPS Valspar Sourcing, Inc. (US) 2017-03-29 EP claimed
CN-106536649-A Polyethers containing cyclic groups other than bisphenols 威士伯采购公司 2017-03-22 CN claimed
US-20170051177-A1 POLYETHERS CONTAINING NON-BISPHENOLIC CYCLIC GROUPS SWIMC LLC 2017-02-23 US claimed
WO-2015179064-A1 POLYETHERS CONTAINING NON-BISPHENOLIC CYCLIC GROUPS VALSPAR SOURCING, INC. (US) 2015-11-26 WO claimed
CN-118139908-A Mannich bases with a high renewable carbon content SIKA技术股份公司 2024-06-04 CN disclosed
CN-118019775-A Bio-based amine curing agents for curable compositions SIKA技术股份公司 2024-05-10 CN disclosed
US-20230295198-A1 VANILLIN-DERIVED FLAME RETARDANT MONOMERS, RESINS, PREPOLYMERS, AND POLYMERS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2023-09-21 US disclosed
US-20230295198-A1 VANILLIN-DERIVED FLAME RETARDANT MONOMERS, RESINS, PREPOLYMERS, AND POLYMERS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2023-09-21 US disclosed
US-20230257625-A1 FOOD OR BEVERAGE CONTACT ARTICLES COATED WITH RESINS DERIVED FROM REACTIONS OF PHENOLS WITH POLYOLEFINIC TERPENES SWIMC LLC (US) 2023-08-17 US disclosed
CN-116554196-A Bio-based thermosetting epoxy resin curing agent and preparation method and application thereof 中国科学院山西煤炭化学研究所 2023-08-08 CN disclosed
WO-2018125895-A1 PACKAGING COATING RESINS DERIVED FROM REACTIONS OF PHENOLS WITH POLYOLEFINIC TERPENES SWIMC, LLC (US) 2018-07-05 WO disclosed
EP-3238750-A1 ORTHOTIC DEVICE MADE OF NATURAL FIBRES AND A POLYEPOXIDE RESIN WITHOUT BISPHENOL A, IN PARTICULAR BIOSOURCED C.O.P. (FR) 2017-11-01 EP disclosed
US-20170051177-A1 POLYETHERS CONTAINING NON-BISPHENOLIC CYCLIC GROUPS SWIMC LLC 2017-02-23 US disclosed
US-20170051177-A1 POLYETHERS CONTAINING NON-BISPHENOLIC CYCLIC GROUPS SWIMC LLC 2017-02-23 US disclosed
WO-2015179064-A1 POLYETHERS CONTAINING NON-BISPHENOLIC CYCLIC GROUPS VALSPAR SOURCING, INC. (US) 2015-11-26 WO disclosed
WO-2015107113-A1 COMBINATION OF CORK / POLYHYDROXYURETHANE BINDER AND METHOD FOR MANUFACTURING SAME DIAM BOUCHAGE (FR) 2015-07-23 WO disclosed
WO-2015107114-A1 COMBINATION OF CORK / POLYEPOXIDE BINDER AND METHOD FOR MANUFACTURING SAME DIAM BOUCHAGE (FR) 2015-07-23 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-20230295198-A1 VANILLIN-DERIVED FLAME RETARDANT MONOMERS, RESINS, PREPOLYMERS, AND POLYMERS PNN, PFAS, POLN DRD4 3170/4885ALDH1A1 1057/4885GLA 1795/4885

“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.