Sugi Predict

Sugi Predict / Compounds / SCHEMBL1193379

SCHEMBL1193379

SCHEMBL1193379

O=C(Cl)c1cccc(Oc2ccccc2)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 1/20 0.72
▸ HDAC8 Q9BY41 2/20 0.64
▸ ERCC5 P28715 1/20 0.58
▸ FEN1 P39748 1/20 0.58
▸ TNKS O95271 1/20 0.56
▸ PARP15 Q460N3 1/20 0.56
▸ PARP14 Q460N5 1/20 0.56
▸ PARP10 Q53GL7 1/20 0.56
▸ TNKS2 Q9H2K2 1/20 0.56
▸ PARP2 Q9UGN5 1/20 0.56
▸ KMO O15229 1/20 0.56
▸ NPC1 O15118 1/20 0.55
▸ PKM P14618 1/20 0.53
▸ KDM4E B2RXH2 1/20 0.51
▸ KAT6A Q92794 1/20 0.51
▸ FAAH O00519 1/20 0.50
▸ HDAC1 Q13547 1/20 0.50
▸ HDAC6 Q9UBN7 1/20 0.50
▸ TLR4 O00206 1/20 0.50
▸ TLR2 O60603 1/20 0.50

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
SCHEMBL10782197 0.98 AKR1C3 (0.70) AKR1C3HDAC8ERCC5FEN1TNKS
SCHEMBL726592 0.94 AKR1C3 (0.62) AKR1C3HDAC8ERCC5FEN1TNKS
SCHEMBL10933601 0.92 AKR1C3 (0.60) AKR1C3HDAC8ERCC5FEN1TNKS
SCHEMBL727287 0.91 PARP10 (0.64) AKR1C3HDAC8ERCC5FEN1TNKS
SCHEMBL7742691 0.91 PARP10 (0.64) AKR1C3HDAC8ERCC5FEN1TNKS
SCHEMBL10496906 0.87 TNKS (0.60) AKR1C3HDAC8ERCC5FEN1TNKS
SCHEMBL19317528 0.86 AKR1C3 (0.58) AKR1C3HDAC8ERCC5FEN1TNKS
SCHEMBL19317527 0.86 AKR1C3 (0.58) AKR1C3HDAC8ERCC5FEN1TNKS
SCHEMBL11217963 0.86 AKR1C3 (0.54) AKR1C3HDAC8ERCC5FEN1TNKS
SCHEMBL6201657 0.86 AKR1C3 (0.54) AKR1C3HDAC8ERCC5FEN1TNKS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4234507-A Process for preparing cyanohydrin esters STAUFFER CHEMICAL COMPANY (US) 1980-11-18 — — US claimed
US-4211727-A CADMIUM BOROHYDRIDE COMPLEX AS REDUCING AGENT SHELL OIL COMPANY (US) 1980-07-08 — — US claimed
US-3953400-A Polyketones and methods therefor RAYCHEM CORPORATION (US) 1976-04-27 — — US claimed
JP-2043220-A — — None — — JP disclosed
US-20200147064-A1 Reduction of Pro-Inflammatory HDL Using a Leukotriene Inhibitor AUTOIMMUNE PHARMA LLC (US) 2020-05-14 — — US disclosed
US-20200147064-A1 Reduction of Pro-Inflammatory HDL Using a Leukotriene Inhibitor AUTOIMMUNE PHARMA LLC (US) 2020-05-14 — — US disclosed
US-10174015-B2 Substituted heterocyclic derivative, preparation method and use thereof XIAMEN UNIVERSITY (CN) 2019-01-08 — — US disclosed
US-20170334896-A1 Substituted Heterocyclic Derivative, Preparation Method And Use Thereof XIAMEN UNIVERSITY (CN) 2017-11-23 — — US disclosed
CN-107074788-A Substituted heterocyclic derivatives, preparation method and application thereof 厦门大学 2017-08-18 — — CN disclosed
US-20150094474-A1 AGRICULTURAL CHEMICALS REDAG CROP PROTECTION LTD (GB) 2015-04-02 — — US disclosed
US-20150094474-A1 AGRICULTURAL CHEMICALS REDAG CROP PROTECTION LTD (GB) 2015-04-02 — — US disclosed
EP-0020988-A2 Process for preparing alpha-cyano-benzyl esters; intermediates therefor and their preparation BAYER AG (DE) 1981-01-07 — — EP disclosed
US-4234507-A Process for preparing cyanohydrin esters STAUFFER CHEMICAL COMPANY (US) 1980-11-18 — — US disclosed
US-4234508-A Process for preparing cyanohydrin esters STAUFFER CHEMICAL COMPANY (US) 1980-11-18 — — US disclosed
EP-0018533-A1 Substituted pentane (or pentene) carboxylic acids and their derivatives, process for their preparation and their use for the preparation of 3-(arylvinyl)-2,2-dimethyl-cyclopropane-1-carboxylates BAYER AG (DE) 1980-11-12 — — EP disclosed
US-4229564-A SUITABLE FOR MELT PROCESSING AND EXTRUSION COATINGS RAYCHEM CORPORATION (US) 1980-10-21 — — US disclosed
US-4182881-A N-[Diaminophosphinyl]arylcarboxamides MORTON-NORWICH PRODUCTS, INC. (US) 1980-01-08 — — US disclosed
US-4161529-A Phenoxy phenyl pyrrolidine compounds, compositions and methods of use SCIENCE UNION ET CIE, SOCIETE FRANCAISE DE RECHERCHE MEDICALE (FR) 1979-07-17 — — US disclosed
US-4024314-A Electrical conductor insulated by a polyketones RAYCHEM CORPORATION (US) 1977-05-17 — — US disclosed
US-3953400-A Polyketones and methods therefor RAYCHEM CORPORATION (US) 1976-04-27 — — 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 (4 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-20150094474-A1 AGRICULTURAL CHEMICALS DDT, SQOR, GPX4 AKR1C3 372/4885HDAC8 813/4885ERCC5 2469/4885
US-20170334896-A1 Substituted Heterocyclic Derivative, Preparation Method And Use Thereof FAAH, NAAA, FAAH2 AKR1C3 925/4885HDAC8 522/4885ERCC5 3494/4885
US-20200147064-A1 Reduction of Pro-Inflammatory HDL Using a Leukotriene Inhibitor LTB4R, LTC4S, LTB4R2 AKR1C3 1102/4885HDAC8 1512/4885ERCC5 4834/4885
US-10174015-B2 Substituted heterocyclic derivative, preparation method and use thereof DHPS, CYP3A5, CYP3A4 AKR1C3 730/4885HDAC8 667/4885ERCC5 993/4885

“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.