SCHEMBL496613

SCHEMBL496613

CC/C=[C]\c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.39
NPSR1 Q6W5P4 2/20 0.36
TSHR P16473 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
THPO P40225 1/20 0.34
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
RELA Q04206 1/20 0.33
HTR2A P28223 1/20 0.33
MAPT P10636 1/20 0.32
LTA4H P09960 1/20 0.32
NPC1 O15118 1/20 0.32
MTOR P42345 1/20 0.32
RAB9A P51151 1/20 0.32
KCNH2 Q12809 1/20 0.31

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
SCHEMBL2927823 1.00 APP (0.39) APPNPSR1TSHRTP53CYP1A2
SCHEMBL496614 1.00 APP (0.39) APPNPSR1TSHRTP53CYP1A2
SCHEMBL6158433 0.81 APP (0.36) APPNPSR1TSHRTP53CYP1A2
SCHEMBL1610832 0.81 APP (0.36) APPNPSR1TSHRTP53CYP1A2
SCHEMBL1611959 0.78 ALDH1A1 (0.42) NPSR1MAPTNPC1RAB9AKCNH2
SCHEMBL4960967 0.78 LTA4H (0.38) APPTSHRTP53CYP1A2CYP3A4
SCHEMBL1611004 0.78 LTA4H (0.38) APPTSHRTP53CYP1A2CYP3A4
SCHEMBL1610304 0.76 CYP2A6 (0.52) TSHRTP53CYP2C9MAPT
SCHEMBL1610492 0.76 LTA4H (0.39) TSHRTP53CYP3A4LTA4H
SCHEMBL7382992 0.76 LTA4H (0.39) TSHRTP53CYP3A4LTA4H

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 1154 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9660195-B2 Anthracene derivative having a phenanthryl group IDEMITSU KOSAN CO., LTD. (JP) 2017-05-23 US claimed
US-8822041-B2 Anthracene derivatives, luminescent materials and organic electroluminescent devices IDEMITSU KOSAN CO., LTD. (JP) 2014-09-02 US claimed
US-20140103319-A1 ANTHRACENE DERIVATIVES, LUMINESCENT MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICES IDEMITSU KOSAN CO., LTD. (JP) 2014-04-17 US claimed
EP-1653960-A4 MELANIN CONCENTRATING HORMONE RECEPTOR ANTAGONIST AMGEN INC (US) 2008-11-26 EP claimed
EP-1654225-A4 MELANIN CONCENTRATING HORMONE RECEPTOR ANTAGONISTS AMGEN INC (US) 2007-11-28 EP claimed
EP-1653960-A2 MELANIN CONCENTRATING HORMONE RECEPTOR ANTAGONIST AMGEN INC. (US) 2006-05-10 EP claimed
EP-1654225-A2 MELANIN CONCENTRATING HORMONE RECEPTOR ANTAGONISTS Amgen, Inc. (US) 2006-05-10 EP claimed
US-20050256161-A1 Melanin concentrating hormone receptor antagonists AMGEN INC. 2005-11-17 US claimed
US-20050215526-A1 Melanin concentrating hormone receptor antagonist AMGEN, INC. 2005-09-29 US claimed
WO-2005019167-A2 MELANIN CONCENTRATING HORMONE RECEPTOR ANTAGONIST AMGEN, INC. (US) 2005-03-03 WO claimed
WO-2001037652-A2 CARBAMOYL TRIAZOLINONE-BASED HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-05-31 WO claimed
EP-0784431-B1 SYNERGISTIC ACTIVE SUBSTANCE HERBICIDE COMBINATIONS WITH 1-(2,6-DICHLORO-4-DIFLUOROMETHYL-PHENYL)-5-(2-CHLOROPROPIONAMIDO)-4-NITROPYRAZOL BAYER AG (DE) 2000-03-08 EP claimed
US-5990044-A Selective herbicides based on aryl uracils BAYER AKTIENGESELLSCHAFT (DE) 1999-11-23 US claimed
EP-0786938-A1 SELECTIVE HERBICIDES BASED ON CARBAMOYLTRIAZOLINONES AND HETEROARYLOXYACETAMIDES BAYER AG (DE) 1997-08-06 EP claimed
EP-0778732-A1 SELECTIVE HERBICIDES BASED ON ARYL URACILS BAYER AG (DE) 1997-06-18 EP claimed
EP-0319986-B1 Anti-plasmin depressant NIPPON SHINYAKU CO LTD (JP) 1997-03-12 EP claimed
WO-1996011575-A1 SELECTIVE HERBICIDES BASED ON CARBAMOYLTRIAZOLINONES AND HETEROARYLOXYACETAMIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-04-25 WO claimed
WO-1996007323-A1 SELECTIVE HERBICIDES BASED ON ARYL URACILS BAYER AKTIENGESELLSCHAFT (DE) 1996-03-14 WO claimed
US-5276008-A Herbicides and plant growth regulators BAYER AKTIENGESELLSCHAFT (DE) 1994-01-04 US claimed
US-4410730-A Process for the production of o-(N-monosubstituted amino)benzyl alcohols SHIONOGI & CO., LTD. (JP) 1983-10-18 US claimed

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-20050215526-A1 Melanin concentrating hormone receptor antagonist MCHR1, MC1R, NPY1R APP 1503/4885NPSR1 35/4885TSHR 17/4885
US-20050256161-A1 Melanin concentrating hormone receptor antagonists MCHR1, MC1R, NPY1R APP 1715/4885NPSR1 27/4885TSHR 19/4885

“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.