SCHEMBL4409744

SCHEMBL4409744

CC=CCCC=CCCC=CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 3/20 0.44
TSHR P16473 3/20 0.44
GABRR1 P24046 2/20 0.44
GABRR2 P28476 2/20 0.44
LMNA P02545 2/20 0.44
APEX1 P27695 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
GABRR3 A8MPY1 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
PPARA Q07869 2/20 0.44
TBXAS1 P24557 1/20 0.41
PPARG P37231 2/20 0.39
PPARD Q03181 1/20 0.39
TP53 P04637 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
EGLN3 Q9H6Z9 1/20 0.38
TOP1 P11387 2/20 0.38
MAPT P10636 2/20 0.35
FFAR1 O14842 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL4409742 1.00 BLM (0.44) BLMTSHRGABRR1GABRR2LMNA
SCHEMBL2382740 0.97 TSHR (0.46) BLMTSHRGABRR1GABRR2LMNA
SCHEMBL2382741 0.97 TSHR (0.46) BLMTSHRGABRR1GABRR2LMNA
Hydrochloric Acid SCHEMBL2558275 0.95 TSHR (0.44) BLMTSHRGABRR1GABRR2LMNA
SCHEMBL28170874 0.91 TOP1 (0.50) BLMLMNAAPEX1NPSR1TDP1
SCHEMBL11535812 0.88 PTPN1 (0.46) BLMTSHRGABRR1GABRR2LMNA
SCHEMBL27995449 0.88 BLM (0.42) BLMTSHRGABRR1GABRR2LMNA
SCHEMBL7746003 0.88 BLM (0.42) BLMTSHRGABRR1GABRR2LMNA
SCHEMBL8551677 0.87 TSHR (0.55) BLMTSHRGABRR1GABRR2LMNA
SCHEMBL8551672 0.87 TSHR (0.55) BLMTSHRGABRR1GABRR2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030068330-A1 Nerve growth factor activity potentiating agents HISAMITSU PHARMACEUTICAL CO., INC. (JP) 2003-04-10 US claimed
EP-1293200-A1 NERVE GROWTH FACTOR ACTIVITY POTENTIATING AGENTS HISAMITSU PHARMACEUTICAL CO. INC. (JP) 2003-03-19 EP claimed
EP-2112135-B1 E2, E4,Z8-undecatrienoic acid and ester and carboxamide derivatives thereof, organoleptic uses thereof and processes for preparing same INT FLAVORS & FRAGRANCES INC (US) 2013-06-19 EP disclosed
EP-1496042-B1 E2, E4,Z8-Undecatrienoic acid and ester and carboxamide derivatives thereof, organoleptic uses thereof and processes for preparing same INT FLAVORS & FRAGRANCES INC (US) 2009-11-11 EP disclosed
EP-2112135-A2 E2, E4,Z8-undecatrienoic acid and ester and carboxamide derivatives thereof, organoleptic uses thereof and processes for preparing same INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2009-10-28 EP disclosed
US-7534817-B1 Kombic acid/sarganol bis-succinate and derivatives as potent apoptogens (antineoplastic agents) with high selectivity for cancer cells LEONARD EDWARD C 2009-05-19 US disclosed
US-7141686-B2 E2, E4, Z8-undecatrienoic acid and ester and carboxamide derivatives thereof, organoleptic uses thereof and processes for preparing same INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2006-11-28 US disclosed
US-7098350-B2 E2,E4,Z8-undecatrienoic acid and ester and carboxamide derivatives thereof, organoleptic uses thereof and processes for preparing same INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2006-08-29 US disclosed
US-20050197387-A1 E2,E4,Z8-undecatrienoic acid and ester and carboxamide derivatives thereof, organoleptic uses thereof and processes for preparing same INTERNATIONAL FLAVORS & FRAGARANCES INC. 2005-09-08 US disclosed
US-20050192343-A1 Nerve growth factor activity potentiating agents GOTO TAKESHI (JP) 2005-09-01 US disclosed
US-20050010062-A1 E2,E4,Z8-UNDECATRIENOIC ACID AND ESTER AND CARBOXAMIDE DERIVATIVES THEREOF, ORGANOLEPTIC USES THEREOF AND PROCESSES FOR PREPARING SAME INTERNATIONAL FLAVORS & FRAGRANCES INC. 2005-01-13 US disclosed
EP-1496042-A2 E2, E4,Z8-Undecatrienoic acid and ester and carboxamide derivatives thereof, organoleptic uses thereof and processes for preparing same INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2005-01-12 EP disclosed
US-20030068330-A1 Nerve growth factor activity potentiating agents HISAMITSU PHARMACEUTICAL CO., INC. (JP) 2003-04-10 US disclosed
EP-1293200-A1 NERVE GROWTH FACTOR ACTIVITY POTENTIATING AGENTS HISAMITSU PHARMACEUTICAL CO. INC. (JP) 2003-03-19 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 (4 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-20050192343-A1 Nerve growth factor activity potentiating agents BDNF, NGF, HDGF BLM 4854/4885TSHR 3475/4885GABRR1 1673/4885
US-20050010062-A1 E2,E4,Z8-UNDECATRIENOIC ACID AND ESTER AND CARBOXAMIDE DERIVATIVES THEREOF, ORGANOLEPTIC USES THEREOF AND PROCESSES FOR PREPARING SAME ESRRA, TECR, TAS2R8 BLM 4612/4885TSHR 457/4885GABRR1 771/4885
US-20030068330-A1 Nerve growth factor activity potentiating agents BDNF, NGF, OGFR BLM 4814/4885TSHR 3510/4885GABRR1 1752/4885
US-20050197387-A1 E2,E4,Z8-undecatrienoic acid and ester and carboxamide derivatives thereof, organoleptic uses thereof and processes for preparing same UBE4A, TAS2R8, CUTA BLM 4841/4885TSHR 2983/4885GABRR1 4088/4885

“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.