SCHEMBL335170

SCHEMBL335170

[CH2]COCCCCCCC

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.52
HTT P42858 2/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
MAPT P10636 1/20 0.52
CES2 O00748 2/20 0.48
ALDH1A1 P00352 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
USP2 O75604 1/20 0.45
TSHR P16473 4/20 0.44
CES1 P23141 1/20 0.43
SPHK1 Q9NYA1 1/20 0.39
LPAR1 Q92633 2/20 0.39
LPAR3 Q9UBY5 2/20 0.39
LPAR2 Q9HBW0 1/20 0.39

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
SCHEMBL132961 1.00 THRB (0.52) THRBHTTMEN1KMT2AMAPT
SCHEMBL983600 1.00 THRB (0.52) THRBHTTMEN1KMT2AMAPT
SCHEMBL981267 1.00 THRB (0.52) THRBHTTMEN1KMT2AMAPT
SCHEMBL493130 1.00 THRB (0.52) THRBHTTMEN1KMT2AMAPT
SCHEMBL22288118 1.00 THRB (0.52) THRBHTTMEN1KMT2AMAPT
SCHEMBL63140 1.00
SCHEMBL16114084 1.00 THRB (0.52) THRBHTTMEN1KMT2AMAPT
SCHEMBL983473 1.00 THRB (0.52) THRBHTTMEN1KMT2AMAPT
SCHEMBL982461 1.00 THRB (0.52) THRBHTTMEN1KMT2AMAPT
SCHEMBL983618 1.00 THRB (0.52) THRBHTTMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9089515-B2 Long chain N-alkyl compounds and oxa-derivatives thereof THOMAS JEFFERSON UNIVERSITY (US) 2015-07-28 US claimed
US-20110184019-A1 Long chain N-Alkyl compounds and oxa-derivatives thereof THOMAS JEFFERSON UNIVERSITY 2011-07-28 US claimed
US-7786332-B2 Process for the preparation of ring compounds MERCK PATENT GMBH (DE) 2010-08-31 US claimed
US-20100137365-A1 Long chain N-alkyl compounds and oxa-derivatives thereof THOMAS JEFFERSON UNIVERSITY 2010-06-03 US claimed
US-7429393-B2 Graft polymer BRIDGESTONE CORPORATION (JP) 2008-09-30 US claimed
US-20030130398-A1 Soft polymeric compounds including metal oxide fillers BRIDGESTONE CORPORATION 2003-07-10 US claimed
US-20030130426-A1 Method of grafting polymaleimides to alkenyl butyl rubbers BRIDGESTONE CORP. 2003-07-10 US claimed
US-20030091527-A1 Graft polymer BRIDGESTONE CORPORATION (JP) 2003-05-15 US claimed
WO-2003016398-A1 THERMOPLASTIC ELASTOMERS AND METHOD OF MAKING THE SAME BRIDGESTONE CORPORATION (US) 2003-02-27 WO claimed
US-20020188064-A1 Poly(alkenyl-co-maleimide) , an inorganic salt, and an extender BRIDGESTONE/FIRESTONE RESEARCH, INC. 2002-12-12 US claimed
WO-2001070822-A2 PROCESS FOR FORMING CENTIPEDE POLYMER GELS BRIDGESTONE CORPORATION (JP) 2001-09-27 WO claimed
US-20010021743-A1 Method of producing a graft copolymer BRIDGESTONE CORPORATION (JP) 2001-09-13 US claimed
US-6191217-B1 REACTING POLY(ALKYL VINYLETHER-CO-MALEIMIDE) POLYMER WITH MALEATED POLYALKYLENE AND ALKYL DIAMINE UNDER SUBSTANTIALLY DRY CONDITIONS SUFFICIENT TO FORM POLYALKYLENE GRAFTED POLY(ALKYL VINYLETHER-CO-MALEIMIDE) POLYMER BRIDGESTONE CORPORATION (JP) 2001-02-20 US claimed
US-6133354-A MIXING A POLY(DIALKYLSUBSTITUTED ETHYLENE-CO-MALEIMIDE) POLYMER SUCH AS POLYISOBUTYLENE-CO-MALEIMIDE, AND PLASTICIZERS OR EXTENDERS WITHIN A NON-VULCANIZED THERMOPLASTIC ELASTOMER TO FORM A DAMPING GEL; TENSILE STRENGTH AND TEAR STRENGTH BRIDGESTONE CORPORATION (JP) 2000-10-17 US claimed
EP-0955319-A1 Soft compounds derived from polypropylene grafted disubstituted ethylene-maleimide copolymers Bridgestone Corporation (JP) 1999-11-10 EP claimed
US-5190689-A Polymer materials having liquid-crystalline phases MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-03-02 US claimed
US-4894181-A Carbocyclic compounds MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-01-16 US claimed
US-4758373-A Carbocyclic compounds MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1988-07-19 US claimed
US-4574123-A BACTERICIDES, FUNGICIDES, STERILIZATION, CONTRACEPTIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-03-04 US claimed
EP-0125091-A2 4,4'-Alkylenedipiperidine derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-11-14 EP 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 (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-20030091527-A1 Graft polymer PARG, PARN, PCNA THRB 4657/4885HTT 2890/4885MEN1 393/4885
US-20100137365-A1 Long chain N-alkyl compounds and oxa-derivatives thereof OXA1L, OTC, PAICS THRB 2907/4885HTT 1700/4885MEN1 3764/4885
US-20110184019-A1 Long chain N-Alkyl compounds and oxa-derivatives thereof OXA1L, OTC, PAICS THRB 2907/4885HTT 1700/4885MEN1 3764/4885

“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.