SCHEMBL2000852

SCHEMBL2000852

CCC=CCCC(C)CCC

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
ALDH1A1 P00352 3/20 0.32
ALOX15 P16050 1/20 0.32
MAPT P10636 2/20 0.31
FFAR1 O14842 1/20 0.31
CYP19A1 P11511 1/20 0.31
RXRA P19793 1/20 0.31
PPARG P37231 1/20 0.31
OXER1 Q8TDS5 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
SCHEMBL2000851 1.00 TSHR (0.40) TSHRALDH1A1ALOX15MAPTFFAR1
SCHEMBL28593482 0.87 TSHR (0.42) TSHRALDH1A1ALOX15
SCHEMBL2005366 0.87 TSHR (0.42) TSHRALDH1A1ALOX15
SCHEMBL2005367 0.87 TSHR (0.42) TSHRALDH1A1ALOX15
SCHEMBL2012453 0.86 ACE2 (0.35) TSHR
SCHEMBL2007167 0.86 TSHR (0.37) TSHRALDH1A1ALOX15MAPTFFAR1
SCHEMBL2007170 0.86 TSHR (0.37) TSHRALDH1A1ALOX15MAPTFFAR1
SCHEMBL2012455 0.86 ACE2 (0.35) TSHR
SCHEMBL27343098 0.84 LMNA (0.37) TSHRALDH1A1ALOX15MAPTFFAR1
SCHEMBL2008509 0.82 ALDH1A1 (0.32) ALDH1A1MAPTFFAR1CYP19A1RXRA

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113113644-B Hydrogen fuel cell system 东风汽车集团股份有限公司 2022-04-15 CN disclosed
US-20120208959-A1 METHOD FOR PRODUCING AN AQUEOUS POLYMER DISPERSION BASF SE (DE) 2012-08-16 US disclosed
US-20120149840-A1 PROCESS FOR PRODUCING AN AQUEOUS POLYMER DISPERSION Univ. of Southern Mississippi Res. Foundation (US) 2012-06-14 US disclosed
US-7960477-B2 Polyamides with acrylate rubbers BASF SE (DE) 2011-06-14 US disclosed
US-7816441-B2 Dispersing assistant for emulsion and suspension polymerization BASF SE (DE) 2010-10-19 US disclosed
US-20100249325-A1 POLYMER POWDER WITH HIGH RUBBER CONTENT AND PRODUCTION THEREOF BASF SE (DE) 2010-09-30 US disclosed
US-20100234506-A1 AQUEOUS BINDER FOR FIBROUS OR GRANULAR SUBSTRATES BASF SE (DE) 2010-09-16 US disclosed
US-20100174025-A1 N-BA-ALKENE COPOLYMERS AS GRAFT BASE FOR ABS POLYMERS BASF SE (DE) 2010-07-08 US disclosed
US-20100152380-A1 PROCESS FOR PREPARING AN AQUEOUS POLYMER DISPERSION BASF SE (DE) 2010-06-17 US disclosed
US-20100093905-A1 AQUEOUS BINDER FOR GRANULAR AND/OR FIBROUS SUBSTRATES BASF SE (DE) 2010-04-15 US disclosed
US-20100069597-A1 FINE-PARTICLED POLYMER DISPERSIONS CONTAINING STARCH BASF SE (DE) 2010-03-18 US disclosed
US-20100048821-A1 POLYAMIDES WITH ACRYLATE RUBBERS BASF SE (DE) 2010-02-25 US disclosed
US-20100022708-A1 DISPERSING ASSISTANT FOR EMULSION AND SUSPENSION POLYMERIZATION BASF SE (DE) 2010-01-28 US disclosed
US-20090275681-A1 PROCESS FOR PREPARING AN AQUEOUS POLYMER DISPERSION BASF SE (DE) 2009-11-05 US disclosed
CN-101558119-A Polyamide containing acrylate rubber BASF SE (DE) 2009-10-14 CN disclosed
US-20080221267-A1 Process for Preparing an Aqueous Addition-Polymer Dispersion BASF AKTIENGESELLSCHAFT (DE) 2008-09-11 US disclosed
US-7037989-B2 Copolymers of ethylene and/or α-olefins and vicinally disubstituted olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-05-02 US disclosed
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed
US-4069232-A Manufacture of gamma-butyrolactones from 1,3-glycols and esters, halides and metadioxanes thereof NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1978-01-17 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 (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-20120149840-A1 PROCESS FOR PRODUCING AN AQUEOUS POLYMER DISPERSION PUF60, PARG, ACMSD TSHR 4835/4885ALDH1A1 3496/4885ALOX15 844/4885

“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.