SCHEMBL2190465

SCHEMBL2190465

C(#Cc1ccccc1)Oc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.52
MAPT P10636 2/20 0.41
FFAR1 O14842 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
THPO P40225 1/20 0.39
TSHR P16473 2/20 0.39
LTA4H P09960 1/20 0.39
KCNA3 P22001 1/20 0.39
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
GRM5 P41594 1/20 0.38
NPC1 O15118 2/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL2476047 0.95 APP (0.52) APPMAPTFFAR1CYP1A2CYP3A4
SCHEMBL15348783 0.85 APP (0.42) APPMAPTFFAR1CYP1A2CYP3A4
SCHEMBL15827936 0.85 VCP (0.44) APPMAPTFFAR1CYP1A2CYP3A4
SCHEMBL13283920 0.85 LTA4H (0.48) APPMAPTFFAR1CYP1A2CYP2C19
SCHEMBL9421959 0.81 LTA4H (0.50) APPTSHRLTA4HKCNA3ALDH1A1
SCHEMBL28516091 0.80 FFAR1 (0.45) APPFFAR1CYP3A4TSHRLTA4H
SCHEMBL427752 0.80 CYP19A1 (0.44) APPFFAR1CYP1A2CYP3A4CYP2C9
SCHEMBL11330504 0.80 MAOB (0.48) MAPTFFAR1CYP3A4ALDH1A1KDM4E
SCHEMBL11330496 0.80 MAOB (0.53) APPMAPTFFAR1CYP1A2CYP3A4
SCHEMBL13283917 0.79 APP (0.41) APPMAPTFFAR1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1643030-A Low dielectric constant materials and methods of preparation thereof HONEYWELL INT INC (US) 2005-07-20 CN claimed
US-3939278-A Phenoxyphenyl-acetylenes and thio analogues thereof as antithrombotic agents ELI LILLY AND COMPANY (US) 1976-02-17 US claimed
CN-113248511-B Synthesis method of pyrano [2,3-b ] quinoline alkaloid 常州大学 2022-05-20 CN disclosed
CN-113248511-A Synthesis method of pyrano [2,3-b ] quinoline alkaloid 常州大学 2021-08-13 CN disclosed
US-9493436-B2 Tyrosine phosphatase inhibitors and uses thereof to modulate the activity of enzymes involved in the pathology of Mycobacterium tuberculosis INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2016-11-15 US disclosed
US-9108930-B2 N1- and N2-carbamoyl-1,2,3-triazole serine hydrolase inhibitors and methods THE SCRIPPS RESEARCH INSTITUTE (US) 2015-08-18 US disclosed
US-20140179735-A1 TYROSINE PHOSPHATASE INHIBITORS AND USES THEREOF TO MODULATE THE ACTIVITY OF ENZYMESp INVOLVED IN THE PATHOLOGY OF MYCOBACTERIUM TUBERCULOSIS INDIANA UNIVERSITY RESEARCH & TECHNOLOGY CORPORATION 2014-06-26 US disclosed
US-20140018318-A1 N1- and N2-CARBAMOYL-1,2,3-TRIAZOLE SERINE HYDROLASE INHIBITORS AND METHODS THE SCIPPS RESEARCH INSTITUTE (US) 2014-01-16 US disclosed
US-8524847-B2 Organic insulating material, varnish for resin film using the same, resin film and semiconductor device SUMITOMO BAKELITE CO., LTD. (JP) 2013-09-03 US disclosed
EP-2157107-B1 ORGANIC INSULATING MATERIAL, VARNISH FOR RESIN FILM USING THE SAME, RESIN FILM AND SEMICONDUCTOR DEVICE SUMITOMO BAKELITE CO (JP) 2013-05-08 EP disclosed
WO-2012149048-A1 TYROSINE PHOSPHATASE INHIBITORS AND USES THEREOF TO MODULATE THE ACTIVITY OF LYP INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2012-11-01 WO disclosed
US-20090318610-A1 ORGANIC INSULATING MATERIALS, VARNISHES FOR ORGANIC INSULATING FILM EMPLOYING THEM, ORGANIC INSULATING FILMS AND SEMICONDUCTOR DEVICES SUMITOMO BAKELITE CO., LTD (JP) 2009-12-24 US disclosed
EP-2117009-A1 ORGANIC INSULATING MATERIAL, VARNISH FOR ORGANIC INSULATING FILM USING THE SAME, ORGANIC INSULATING FILM AND SEMICONDUCTOR DEVICE Sumitomo Bakelite Co., Ltd. (JP) 2009-11-11 EP disclosed
CN-1643030-A Low dielectric constant materials and methods of preparation thereof HONEYWELL INT INC (US) 2005-07-20 CN disclosed
US-5723573-A ACETYLENIC END GROUPS HITACHI CHEMICAL COMPANY, LTD. (JP) 1998-03-03 US disclosed
EP-0670856-A1 THERMOSETTABLE COMPOSITION CONTAINING MESOGENIC MOIETIES THE DOW CHEMICAL COMPANY (US) 1995-09-13 EP disclosed
WO-1994012556-A2 THERMOSETTABLE COMPOSITION CONTAINING DISCOTIC MESOGENIC MOIETIES THE DOW CHEMICAL COMPANY (US) 1994-06-09 WO disclosed
US-3939278-A Phenoxyphenyl-acetylenes and thio analogues thereof as antithrombotic agents ELI LILLY AND COMPANY (US) 1976-02-17 US disclosed
US-3939278-A Phenoxyphenyl-acetylenes and thio analogues thereof as antithrombotic agents ELI LILLY AND COMPANY (US) 1976-02-17 US disclosed
US-3939278-A Phenoxyphenyl-acetylenes and thio analogues thereof as antithrombotic agents ELI LILLY AND COMPANY (US) 1976-02-17 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 (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-20140018318-A1 N1- and N2-CARBAMOYL-1,2,3-TRIAZOLE SERINE HYDROLASE INHIBITORS AND METHODS PRSS1, PRSS3, CES1 APP 1376/4885MAPT 4098/4885FFAR1 3487/4885
US-20140179735-A1 TYROSINE PHOSPHATASE INHIBITORS AND USES THEREOF TO MODULATE THE ACTIVITY OF ENZYMESp INVOLVED IN THE PATHOLOGY OF MYCOBACTERIUM TUBERCULOSIS PPP3CB, PPP4C, PTPRB APP 2247/4885MAPT 2475/4885FFAR1 4453/4885

“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.