SCHEMBL4108490

SCHEMBL4108490

PC1c2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.46
HTR2A P28223 2/20 0.46
ACHE P22303 3/20 0.40
BCHE P06276 2/20 0.40
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
POLB P06746 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CHRM2 P08172 1/20 0.37
HTR1A P08908 1/20 0.37
ADRA2A P08913 1/20 0.37
CHRM1 P11229 1/20 0.37
DRD1 P21728 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
SCHEMBL24473932 0.82 GPR3 (0.34) GPR3HTR2AACHEBCHEHDAC3
SCHEMBL524603 0.73 GPR3 (0.50) GPR3HTR2AACHEBCHEHDAC3
SCHEMBL29950614 0.73 GPR3 (0.50) GPR3HTR2AACHEBCHEHDAC3
SCHEMBL1107108 0.71 GPR3 (0.48) GPR3HTR2AACHEBCHEHDAC3
SCHEMBL825558 0.71 HTR2A (0.55) GPR3HTR2AACHEBCHEHDAC3
Hydrochloric Acid SCHEMBL9054770 0.71 GPR3 (0.42) GPR3HTR2AACHEBCHEHDAC3
SCHEMBL6420010 0.71 HTR2A (0.50) HTR2AACHEBCHEPOLBCYP2D6
SCHEMBL11302125 0.69 MAOA (0.58) HDAC3HDAC4HDAC7HDAC8HDAC6
SCHEMBL1766205 0.69 GPR3 (0.46) GPR3HTR2AACHEBCHEHDAC3
SCHEMBL40599 0.69 GPR3 (0.52) GPR3HTR2AACHEBCHEHDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090253907-A1 CYCLOPENTADIENYL, INDENYL OR FLUORENYL SUBSTITUTED PHOSPHINE COMPOUNDS AND THEIR USE IN CATALYTIC REACTIONS EVONIK DEGUSSA GMBH (DE) 2009-10-08 US claimed
EP-1894938-A1 New cyclopentadienyl, indenyl or fluorenyl substituted phosphine compounds and their use in catalytic reactions Evonik Degussa GmbH (DE) 2008-03-05 EP claimed
US-12043680-B2 Ethylene and isoprene copolymer COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2024-07-23 US disclosed
US-12043680-B2 Ethylene and isoprene copolymer COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2024-07-23 US disclosed
US-20240218104-A1 FUNCTIONAL COPOLYMER OF A 1,3-DIENE AND ETHYLENE OR A 1,3-DIENE, ETHYLENE AND AN ALPHA-MONOOLEFIN COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2024-07-04 US disclosed
US-20240218104-A1 FUNCTIONAL COPOLYMER OF A 1,3-DIENE AND ETHYLENE OR A 1,3-DIENE, ETHYLENE AND AN ALPHA-MONOOLEFIN COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2024-07-04 US disclosed
US-20240026058-A1 SYNTHESIS OF BLOCK POLYMERS BASED ON 1,3-DIENE AND ETHYLENE UNIVERSITÉ CLAUDE BERNARD LYON 1 (FR) 2024-01-25 US disclosed
US-20240026058-A1 SYNTHESIS OF BLOCK POLYMERS BASED ON 1,3-DIENE AND ETHYLENE UNIVERSITÉ CLAUDE BERNARD LYON 1 (FR) 2024-01-25 US disclosed
WO-2023237380-A1 COUPLED POLYETHYLENES OR COPOLYMERS OF ETHYLENE AND 1,3-DIENE, AND PROCESS FOR THE PREPARATION THEREOF COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2023-12-14 WO disclosed
WO-2023237381-A1 PROCESS FOR THE SYNTHESIS OF POLYETHYLENES OR COPOLYMERS OF ETHYLENE AND 1,3-DIENE HAVING A TERMINAL KETONE FUNCTION COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2023-12-14 WO disclosed
US-20230357462-A1 CATALYTIC SYSTEM BASED ON A METALLOCENE AND A DIORGANOMAGNESIUM COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2023-11-09 US disclosed
US-20040256616-A1 Process of preparing a disubstituted 9-alkylidenefluorene or a derivative thereof MERCK PATENT GMBH (DE) 2004-12-23 US disclosed
EP-1468988-A1 Process of preparing disubstituted 9-alkylidenefluorenes and derivatives thereof MERCK PATENT GmbH (DE) 2004-10-20 EP disclosed
EP-0442638-B1 Polymeric compounds DU PONT UK (GB) 1996-07-10 EP disclosed
US-5278022-A Photopolymerizable E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-01-11 US disclosed
EP-0358400-B1 Improvements in or relating to polymeric compounds DU PONT (US) 1993-11-10 EP disclosed
US-5162431-A Photosensitive Binders DU PONT-HOWSON LIMITED (GB) 1992-11-10 US disclosed
US-5120799-A POLYMERIC COMPOUNDS HAVING PENDANT SULPHONATO GROUPS AND METHOD OF PRODUCING THE POLYMERIC COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY (INC.) (US) 1992-06-09 US disclosed
EP-0442638-A2 Polymeric compounds Du Pont (UK) Limited (GB) 1991-08-21 EP disclosed
EP-0358400-A2 Improvements in or relating to polymeric compounds E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-03-14 EP 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-20230357462-A1 CATALYTIC SYSTEM BASED ON A METALLOCENE AND A DIORGANOMAGNESIUM REL, DNMT1, MED16 GPR3 2068/4885HTR2A 4747/4885ACHE 27/4885
US-20090253907-A1 CYCLOPENTADIENYL, INDENYL OR FLUORENYL SUBSTITUTED PHOSPHINE COMPOUNDS AND THEIR USE IN CATALYTIC REACTIONS CPS1, CYCS, RRS1 GPR3 669/4885HTR2A 3916/4885ACHE 3578/4885
US-20040256616-A1 Process of preparing a disubstituted 9-alkylidenefluorene or a derivative thereof PFAS, FDPS, ALG8 GPR3 4341/4885HTR2A 3442/4885ACHE 4326/4885

“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.