SCHEMBL2866260

SCHEMBL2866260

CCCc1ccc(OP(Oc2ccc(CCC)cc2)Oc2ccc(CCC)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.47
LPL P06858 1/20 0.43
LIPG Q9Y5X9 1/20 0.43
ALDH1A1 P00352 2/20 0.42
CA2 P00918 1/20 0.41
KMT2A Q03164 2/20 0.40
PLA2G1B P04054 1/20 0.40
ATG4B Q9Y4P1 1/20 0.40
RAB9A P51151 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
MGLL Q99685 1/20 0.38
PLK1 P53350 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 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
SCHEMBL446441 0.92 THRB (0.42) THRBLPLLIPGALDH1A1KMT2A
SCHEMBL3383545 0.87 CA2 (0.47) THRBALDH1A1CA2KMT2APLK1
SCHEMBL1160529 0.85 ALDH1A1 (0.52) THRBLPLLIPGALDH1A1CA2
SCHEMBL11867221 0.84 ALDH1A1 (0.55) THRBLPLLIPGALDH1A1KMT2A
SCHEMBL11871536 0.84 ALDH1A1 (0.55) THRBLPLLIPGALDH1A1KMT2A
SCHEMBL11864952 0.84 ALDH1A1 (0.55) THRBLPLLIPGALDH1A1KMT2A
SCHEMBL11876591 0.84 ALDH1A1 (0.55) THRBLPLLIPGALDH1A1KMT2A
SCHEMBL11159991 0.84 ALDH1A1 (0.55) THRBLPLLIPGALDH1A1KMT2A
SCHEMBL10940348 0.84 ALDH1A1 (0.55) THRBLPLLIPGALDH1A1KMT2A
SCHEMBL11771239 0.84 ALDH1A1 (0.55) THRBLPLLIPGALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005010028-A1 ALPHA-AMINO ACID BENZOTHIAZOLYLTHIO ESTER AS INTERMEDIATES FOR MANUFACTURE OF ACE INHIBITORS AND PROCESS FOR PREPARATION THEREOF LUPIN LIMITED (IN) 2005-02-03 WO claimed
EP-2980060-B1 METHOD FOR PRODUCING DIALDEHYDE KURARAY CO (JP) 2020-10-28 EP disclosed
US-9464018-B2 Method for producing dialdehyde KURARAY CO., LTD. (JP) 2016-10-11 US disclosed
US-20160052852-A1 METHOD FOR PRODUCING DIALDEHYDE KURARAY CO., LTD. (JP) 2016-02-25 US disclosed
EP-2980060-A1 METHOD FOR PRODUCING DIALDEHYDE Kuraray Co., Ltd. (JP) 2016-02-03 EP disclosed
US-7842843-B2 Mixture containing 1,3-butadiene and process for producing the same KURARAY CO., LTD. (JP) 2010-11-30 US disclosed
EP-1728796-B1 BISPHOSPHITE AND PROCESS FOR PRODUCING ALDEHYDE COMPOUND WITH THE BISPHOSPHITE KURARAY CO LTD KURASHIKI PLANT (JP) 2010-03-17 EP disclosed
US-7491850-B2 Useful component of catalysts used in the hydroformylation of olefins with carbon monoxide and hydrogen; reaction under milder conditions KURARAY CO., LTD. (JP) 2009-02-17 US disclosed
US-20070197834-A1 Useful component of catalysts used in the hydroformylation of olefins with carbon monoxide and hydrogen; reaction under milder conditions KURARAY CO., LTD (JP) 2007-08-23 US disclosed
EP-1795578-A2 Mixture containing 1, 3-Butadiene and process for producing the same Kuraray Co., Ltd. (JP) 2007-06-13 EP disclosed
US-4240988-A WITH TERTIARY AMINE BASES OR HALIDE COMPLEXING AGENTS ELI LILLY AND COMPANY (US) 1980-12-23 US disclosed
US-4230644-A DERIVED FROM TRIARYL PHOSPHITES AND CHLORINE OR BROMINE ELI LILLY AND COMPANY (US) 1980-10-28 US disclosed
US-4226986-A 7-ACYLAMINO-3-HYDROXY-3-CEPHEM COMPOUND, TRIARYL PHOSPHITE DIHALIDE ELI LILLY AND COMPANY (US) 1980-10-07 US disclosed
US-4223133-A USING A TRIARYL PHOSPHITE-HALOGEN COMPLEX ELI LILLY AND COMPANY (US) 1980-09-16 US disclosed
EP-0015079-A1 Halogenating compounds and a process for their production ELI LILLY AND COMPANY (US) 1980-09-03 EP disclosed
EP-0015080-A1 Process for the stabilization of halogenating compound and stabilized halogenating compositions ELI LILLY AND COMPANY (US) 1980-09-03 EP disclosed
EP-0014566-A1 Halogenated beta-lactam compounds and process for their preparation ELI LILLY AND COMPANY (US) 1980-08-20 EP disclosed
EP-0014567-A1 Processes for preparation of beta-lactam compounds ELI LILLY AND COMPANY (US) 1980-08-20 EP disclosed
US-4211702-A TRIARYLPHOSPHITE-HALOGEN COMPLEX HALOGENATING AGENT ELI LILLY AND COMPANY (US) 1980-07-08 US disclosed
US-3985673-A BY INCORPORATING AN ORGANIC PHOSPHITE PHILLIPS PETROLEUM COMPANY (US) 1976-10-12 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 (2 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-20160052852-A1 METHOD FOR PRODUCING DIALDEHYDE ENO1, ALDH1A2, DERA THRB 1918/4885LPL 4065/4885LIPG 4030/4885
US-20070197834-A1 Useful component of catalysts used in the hydroformylation of olefins with carbon monoxide and hydrogen; reaction under milder conditions OXER1, OXGR1, OXSR1 THRB 1787/4885LPL 4837/4885LIPG 4834/4885

“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.