SCHEMBL986987

SCHEMBL986987

O=Cc1ccnc(C=O)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
KDM4E B2RXH2 2/20 0.38
PTGS2 P35354 1/20 0.38
RAB9A P51151 1/20 0.38
CYP2A6 P11509 2/20 0.36
CCR1 P32246 2/20 0.35
CCR5 P51681 1/20 0.35
CCR8 P51685 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
FGFR1 P11362 1/20 0.35
TSHR P16473 1/20 0.34
UNG P13051 1/20 0.33
FDPS P14324 1/20 0.33

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
SCHEMBL29163627 0.85 ALDH1A1 (0.35) ALDH1A1CCR1CCR5CCR8TSHR
SCHEMBL30786154 0.85 ALDH1A1 (0.34) ALDH1A1KDM4EPTGS2RAB9ACYP2A6
SCHEMBL3465730 0.78 ALDH1A1 (0.35) ALDH1A1
SCHEMBL9347247 0.78 KDM4E (0.56) ALDH1A1KDM4ERAB9ACYP2A6LMNA
SCHEMBL7609085 0.78 ERN1 (0.38) ALDH1A1KDM4ERAB9ACCR1CCR5
SCHEMBL29387096 0.78 CCR1 (0.42) ALDH1A1KDM4EPTGS2RAB9ACYP2A6
SCHEMBL730405 0.78 CCR1 (0.42) ALDH1A1KDM4EPTGS2RAB9ACYP2A6
SCHEMBL30259554 0.76 CCR1 (0.41) ALDH1A1KDM4EPTGS2RAB9ACYP2A6
SCHEMBL30259309 0.76 CCR1 (0.41) ALDH1A1KDM4EPTGS2RAB9ACYP2A6
SCHEMBL24766044 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114874722-B Moisture-heat-resistant epoxy conductive adhesive, preparation method and application thereof 东莞市德聚胶接技术有限公司 2023-01-10 CN claimed
CN-114874722-A Moisture-heat-resistant epoxy conductive adhesive, preparation method and application thereof 东莞市德聚胶接技术有限公司 2022-08-09 CN claimed
EP-3303308-B1 SEPARATION OF ENANTIOMERS OF 3-ETHYLBICYCLO[3.2.0]HEPT-3-EN-6-ONE NOVASSAY SA (CH) 2019-10-09 EP claimed
US-10150723-B2 Separation of enantiomers of 3-ethylbicyclo[3.2.0]hept-3-en-6-one NOVASSAY S.A. (CH) 2018-12-11 US claimed
US-20180134643-A1 SEPARATION OF ENANTIOMERS OF 3-ETHYLBICYCLO[3.2.0]HEPT-3-EN-6-ONE NOVASSAY S.A. (CH) 2018-05-17 US claimed
EP-3303308-A1 SEPARATION OF ENANTIOMERS OF 3-ETHYLBICYCLO[3.2.0]HEPT-3-EN-6-ONE Novassay SA (CH) 2018-04-11 EP claimed
CN-106434754-A Composite containing anti-PD-1 gene and polycation and its application in treating cancer 上海云舜生物技术有限公司 2017-02-22 CN claimed
CN-106399380-A Compound containing anti-PD (Program Death)-1 gene and poly-spermidine and application of compound to treatment of tumors 上海云舜生物技术有限公司 2017-02-15 CN claimed
WO-2016146299-A1 SEPARATION OF ENANTIOMERS OF 3-ETHYLBICYCLO[3.2.0]HEPT-3-EN-6-ONE NOVASSAY SA (CH) 2016-09-22 WO claimed
CN-104353085-A Poly spermine polymer-contained nano-particle, and preparation method and application thereof UNIV SHANGHAI JIAOTONG 2015-02-18 CN claimed
CN-104324387-A BDNF gene-PEI derivative nano-particle composition, preparation method and application thereof XINHUA HOSPITAL AFFILIATED TO SHANGHAI JIAO TONG U 2015-02-04 CN claimed
CN-104288783-A Polycation nanoparticle for treating aplastic bone marrow as well as preparation method and application thereof UNIV SHANGHAI JIAOTONG 2015-01-21 CN claimed
CN-104258417-A GDNF gene-PEI derivative nano-particle compound as well as preparation method and application thereof XINHUA HOSPITAL AFFILIATED TO SHANGHAI JIAO TONG U 2015-01-07 CN claimed
CN-104257630-A Polycationic nucleic acid compound nano-particles as well as preparation method and application thereof UNIV SHANGHAI JIAOTONG 2015-01-07 CN claimed
CN-104248771-A NGF (Nerve Growth Factor) gene and PEI (Polyether Imide) derivative nano-particle compound and preparing method and application thereof XINHUA HOSPITAL AFFILIATED TO SHANGHAI JIAO TONG U 2014-12-31 CN claimed
US-20110006295-A1 COMPOUNDS HAVING ELECTROLUMINESCENT OR ELECTRON TRANSPORT PROPERTIES MERCK PATENT GMBH 2011-01-13 US claimed
EP-2250151-A1 COMPOUNDS HAVING ELECTROLUMINESCENT OR ELECTRON TRANSPORT PROPERTIES Merck Patent GmbH (DE) 2010-11-17 EP claimed
WO-2009112854-A1 COMPOUNDS HAVING ELECTROLUMINESCENT OR ELECTRON TRANSPORT PROPERTIES MERCK PATENT GMBH (DE) 2009-09-17 WO claimed
US-20240309181-A1 RUBBER COMPOSITION AND TIRE BRIDGESTONE CORPORATION (JP) 2024-09-19 US disclosed
US-4172937-A REACTION OF A DIALDEHYDE AND DIAMINE IN A PHENOLIC COMPOUND ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1979-10-30 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-20110006295-A1 COMPOUNDS HAVING ELECTROLUMINESCENT OR ELECTRON TRANSPORT PROPERTIES NR2E3, NR4A2, NR4A3 ALDH1A1 420/4885KDM4E 2623/4885PTGS2 2501/4885
US-20180134643-A1 SEPARATION OF ENANTIOMERS OF 3-ETHYLBICYCLO[3.2.0]HEPT-3-EN-6-ONE ALDH7A1, OPRK1, SCN3A ALDH1A1 14/4885KDM4E 2811/4885PTGS2 556/4885
US-10150723-B2 Separation of enantiomers of 3-ethylbicyclo[3.2.0]hept-3-en-6-one ALDH7A1, OPRK1, SCN3A ALDH1A1 14/4885KDM4E 2811/4885PTGS2 556/4885

“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.