SCHEMBL2118732

SCHEMBL2118732

CCC1CCCCN1CCCO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.47
S1PR1 P21453 3/20 0.46
S1PR3 Q99500 3/20 0.46
S1PR5 Q9H228 3/20 0.46
OPRD1 P41143 2/20 0.41
TERT O14746 2/20 0.41
S1PR4 O95977 1/20 0.41
TSHR P16473 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
SPHK2 Q9NRA0 2/20 0.39
SPHK1 Q9NYA1 2/20 0.39
MAPK1 P28482 1/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL2116370 0.94 S1PR1 (0.45) HSD17B10S1PR1S1PR3S1PR5OPRD1
SCHEMBL6683104 0.89 TERT (0.43) HSD17B10S1PR1S1PR3S1PR5TERT
SCHEMBL10220860 0.85 S1PR1 (0.51) HSD17B10S1PR1S1PR3S1PR5OPRD1
SCHEMBL3430851 0.83 S1PR1 (0.47) S1PR1S1PR3S1PR5OPRD1TERT
SCHEMBL3431907 0.83 S1PR1 (0.47) S1PR1S1PR3S1PR5OPRD1TERT
SCHEMBL3424382 0.83 S1PR1 (0.47) S1PR1S1PR3S1PR5OPRD1TERT
SCHEMBL12067113 0.82 SPHK2 (0.42) HSD17B10S1PR1S1PR3S1PR5OPRD1
SCHEMBL9975336 0.82 SPHK2 (0.42) HSD17B10S1PR1S1PR3S1PR5OPRD1
SCHEMBL23828675 0.82 S1PR1 (0.50) HSD17B10S1PR1S1PR3S1PR5OPRD1
SCHEMBL23828673 0.82 S1PR1 (0.46) HSD17B10S1PR1S1PR3S1PR5OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7087549-B2 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY (US) 2006-08-08 US claimed
US-20050181935-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY 2005-08-18 US claimed
EP-0990670-B1 Calcium-based catalyst system GOODYEAR TIRE & RUBBER (US) 2004-11-03 EP claimed
US-20020045720-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY 2002-04-18 US claimed
US-6359088-B1 COPOLYMERIZING STYRENE AND 1,3-BUTADIENE IN AN ORGANIC SOLVENT IN THE PRESENCE OF CATALYST SYSTEM WHICH CONSISTS ESSENTIALLY OF AN ORGANOLITHIUM COMPOUND, A CALCIUM ALKOXIDE AND A LITHIUM ALKOXIDE THE GOODYEAR TIRE & RUBBER COMPANY 2002-03-19 US claimed
US-6103842-A USING CATALYST SYSTEM FOR EXOTHERMAL POLYMERIZATION WHICH CONSISTS ESSENTIALLY OF (A) AN ORGANOLITHIUM COMPOUND, (B) A BARIUM ALKOXIDE AND (C) A LITHIUM ALKOXIDE THE GOODYEAR TIRE & RUBBER COMPANY (US) 2000-08-15 US claimed
EP-0990670-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY (US) 2000-04-05 EP claimed
EP-0391692-B1 Process for producing high trans low vinyl conjugated diene (co) polymer JAPAN SYNTHETIC RUBBER CO LTD (JP) 1994-01-05 EP claimed
US-5086136-A Using coordination catalyst containing organoaluminum compound, barium compound and alcohol JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1992-02-04 US claimed
EP-0391692-A1 Process for producing high trans low vinyl conjugated diene (co) polymer JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1990-10-10 EP claimed
US-8158652-B2 1-Difluoromethyl-5-{4-[3-(1-piperidinyl)propoxy]phenyl}-2(1H)-pyridone; compounds act as histamine-H3 receptor antagonistic substances or inverse-agonistic substances; useful as preventives or remedies for various circular system diseases, nervous system diseases, metabolic system diseases MSD K.K. (JP) 2012-04-17 US disclosed
US-20080269287-A1 Substituted Pyridone Derivative MSD K.K. (JP) 2008-10-30 US disclosed
EP-1820797-A1 SUBSTITUTED PYRIDONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-22 EP disclosed
US-7087549-B2 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY (US) 2006-08-08 US disclosed
US-20050181935-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY 2005-08-18 US disclosed
EP-0331400-B1 CATALYST COMPOSITION FOR POLYMERIZATION OF CONJUGATED DIENE AND PROCESS FOR PRODUCING CONJUGATED DIENE POLYMER JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1992-01-08 EP disclosed
US-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 US disclosed
EP-0391692-A1 Process for producing high trans low vinyl conjugated diene (co) polymer JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1990-10-10 EP disclosed
US-4933401-A ORGANO-LITHIUM-ALUMINUM COMPOUND JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1990-06-12 US disclosed
EP-0331400-A1 Catalyst composition for polymerization of conjugated diene and process for producing conjugated diene polymer JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1989-09-06 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 (1 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-20080269287-A1 Substituted Pyridone Derivative HRH3, HRH4, HRH1 HSD17B10 504/4885S1PR1 476/4885S1PR3 567/4885

“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.