SCHEMBL513660

SCHEMBL513660

[CH2]C(=O)c1ccccc1OC

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.58
STAT3 P40763 1/20 0.55
LMNA P02545 1/20 0.54
HTT P42858 2/20 0.53
NPC1 O15118 3/20 0.53
RAB9A P51151 2/20 0.53
ABCG2 Q9UNQ0 1/20 0.53
KCNK3 O14649 1/20 0.51
KCNK9 Q9NPC2 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HPGD P15428 2/20 0.50
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
RXFP1 Q9HBX9 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
SCHEMBL870484 0.82 CTSD (0.62) CTSDSTAT3HTTNPC1RAB9A
SCHEMBL29658169 0.82 CTSD (0.62) CTSDSTAT3LMNAHTTNPC1
SCHEMBL322168 0.82 CTSD (0.62) CTSDSTAT3LMNAHTTNPC1
SCHEMBL2098153 0.82 KMT2A (0.55) LMNAHTTNPC1RAB9ASMN1; SMN2
SCHEMBL26118521 0.81 CTSD (0.56) CTSDSTAT3HTTNPC1RAB9A
Formaldehyde SCHEMBL28303539 0.81 SMN1; SMN2 (0.64) CTSDSTAT3LMNAHTTNPC1
SCHEMBL29365231 0.80 HTT (0.78) CTSDSTAT3LMNAHTTNPC1
SCHEMBL29432808 0.80 SMN1; SMN2 (0.68) CTSDSTAT3LMNAHTTNPC1
SCHEMBL49886 0.80 CTSD (0.60) CTSDSTAT3HTTNPC1RAB9A
SCHEMBL54071 0.80 SMN1; SMN2 (0.68) CTSDSTAT3LMNAHTTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108299401-A A kind of 3- benzyls substituted cumarin-imidazole salt compound and preparation method thereof 红河学院 2018-07-20 CN claimed
CN-101384594-A Condensed heterocyclic compounds useful as dpp-iv inhibitors NOVARTIS AG (CH) 2009-03-11 CN claimed
US-20080119522-A1 5,6-dichloro-2-(2,2,2-trifluoro-ethyl)-1H-benzimidazole for example; use for prostate cancer, benign prostatic hyperplasia (BPH), hirsutism, alopecia, anorexia nervosa, breast cancer, acne, AIDS, cachexia, as a male contraceptive, and/or as a male performance enhancer NG RAYMOND 2008-05-22 US claimed
EP-1812406-A2 NOVEL BENZIMIDAZOLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA N.V. (BE) 2007-08-01 EP claimed
US-20060111402-A1 Novel benzimidazole derivatives useful as selective androgen receptor modulators (SARMS) JANSSEN PHARMACEUTICA N.V. (BE) 2006-05-25 US claimed
WO-2006039215-A2 NOVEL BENZIMIDAZOLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA N.V. (BE) 2006-04-13 WO claimed
US-6096836-A OXYGEN CONTAINING AROMATIC CATALYST AND ALUMINUM COMPOUND KABUSHIKI KAISHA TOSHIBA (JP) 2000-08-01 US claimed
US-5482816-A RESISTS JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1996-01-09 US claimed
US-5376498-A Blend of an alkali-soluble resin, compound that generates an acid upon irradiation, functional aromatic compound and a phenolic compound JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1994-12-27 US claimed
EP-0542572-A1 Negative type radiation-sensitive resin composition JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1993-05-19 EP claimed
US-4361514-A Carbon analogs of penicillin MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1982-11-30 US claimed
US-4282149-A Carbon and oxygen analogs of penicillin MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1981-08-04 US claimed
US-4143046-A CARBON AND OXYGEN ANALOGS OF PENICILLIN MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1979-03-06 US claimed
US-4075340-A ANTIINFLAMMATORY, ANTIARRYTHMIC, ANTICOAGULANTS PARCOR (FR) 1978-02-21 US claimed
WO-2023210623-A1 HALOALKYL SULFONE ANILIDE COMPOUND AND HERBICIDE CONTAINING SAME 株式会社エス・ディー・エス バイオテック 2023-11-02 WO disclosed
US-11764043-B2 Methods of mass spectrometry quantitation using cleavable isobaric tags and neutral loss fragmentation THERMO FINNIGAN LLC 2023-09-19 US disclosed
US-20230212132-A1 AMINIMIDE COMPOUND, AMINIMIDE COMPOSITION, CURING AGENT, EPOXY RESIN COMPOSITION, METHOD FOR PRODUCING AMINIMIDE COMPOUND, ENCAPSULANT, AND ADHESIVE ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-07-06 US disclosed
US-4125533-A STABILIZERS SANKYO CO. LTD. (JP) 1978-11-14 US disclosed
US-4016168-A STABILIZERS FOR POLYMERS SANKYO COMPANY LIMITED (JA) 1977-04-05 US disclosed
US-3971825-A (5,6) (10,11) BIS-METHYLENE, BRONCHODILATORS SANKYO COMPANY LIMITED (JA) 1976-07-27 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 (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-20060111402-A1 Novel benzimidazole derivatives useful as selective androgen receptor modulators (SARMS) AR, NR5A1, ESRRA CTSD 3149/4885STAT3 523/4885LMNA 3422/4885
US-20230212132-A1 AMINIMIDE COMPOUND, AMINIMIDE COMPOSITION, CURING AGENT, EPOXY RESIN COMPOSITION, METHOD FOR PRODUCING AMINIMIDE COMPOUND, ENCAPSULANT, AND ADHESIVE ITGAL, VCL, RPL39 CTSD 4359/4885STAT3 4587/4885LMNA 1690/4885
US-20080119522-A1 5,6-dichloro-2-(2,2,2-trifluoro-ethyl)-1H-benzimidazole for example; use for prostate cancer, benign prostatic hyperplasia (BPH), hirsutism, alopecia, anorexia nervosa, breast cancer, acne, AIDS, cachexia, as a male contraceptive, and/or as a male performance enhancer AR, FSHR, BRDT CTSD 1323/4885STAT3 414/4885LMNA 4079/4885

“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.