SCHEMBL3635581

SCHEMBL3635581

CC(=O)CCCCCCCCCCCCCCOc1ccc(C(C)(C)c2ccc(O)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.51
KDM4E B2RXH2 8/20 0.48
ALDH1A1 P00352 5/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
HTT P42858 1/20 0.48
GAA P10253 1/20 0.47
POLB P06746 2/20 0.46
ESR1 P03372 2/20 0.46
CYP3A4 P08684 1/20 0.46
AR P10275 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
HTR6 P50406 1/20 0.46
ESRRG P62508 1/20 0.46
SLC6A3 Q01959 1/20 0.46
ESR2 Q92731 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
Acetone SCHEMBL3639677 0.99 NR5A1 (0.50) NR5A1KDM4EALDH1A1MEN1KMT2A
SCHEMBL14962788 0.94 KDM4E (0.50) NR5A1KDM4EALDH1A1MEN1KMT2A
SCHEMBL25794785 0.89 NR5A1 (0.62) NR5A1GAATSHRLTA4HL3MBTL1
SCHEMBL15887764 0.89 NR5A1 (0.62) NR5A1GAATSHRLTA4HL3MBTL1
SCHEMBL25794749 0.89 NR5A1 (0.62) NR5A1GAATSHRLTA4HL3MBTL1
SCHEMBL9453956 0.89 NR5A1 (0.51) NR5A1KDM4EALDH1A1MEN1KMT2A
SCHEMBL28925379 0.85 SMN1; SMN2 (0.54) KDM4EALDH1A1MEN1KMT2AGAA
SCHEMBL2947534 0.81 ALDH1A1 (0.67) KDM4EALDH1A1MEN1KMT2AHTT
SCHEMBL9394712 0.80 NR5A1 (0.74) NR5A1KDM4EALDH1A1MEN1KMT2A
SCHEMBL134271 0.80 ESR1 (0.53) KDM4EALDH1A1MEN1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2167566-B1 METHOD FOR STORAGE AND/OR TRANSPORT OF BISPHENOLACETONE AND METHOD FOR PRODUCING AROMATIC POLYCARBONATE SHELL INT RESEARCH (NL) 2012-05-16 EP claimed
EP-2167566-A1 METHOD FOR STORAGE AND/OR TRANSPORT OF BISPHENOLACETONE AND METHOD FOR PRODUCING AROMATIC POLYCARBONATE Shell Internationale Research Maatschappij B.V. (NL) 2010-03-31 EP claimed
WO-2009010486-A1 METHOD FOR STORAGE AND/OR TRANSPORT OF BISPHENOLACETONE AND METHOD FOR PRODUCING AROMATIC POLYCARBONATE SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2009-01-22 WO claimed
US-20090023884-A1 METHOD FOR STORAGE AND/OR TRANSPORT OF BISPHENOLACETONE AND METHOD FOR PRODUCING AROMATIC POLYCARBONATE SHELL OIL COMPANY 2009-01-22 US claimed
EP-1668061-B1 METHOD FOR PRODUCING POLYCARBONATE SHELL INT RESEARCH (NL) 2008-02-20 EP claimed
US-7067610-B2 Method for producing polycarbonate SHELL OIL COMPANY (US) 2006-06-27 US claimed
EP-1668061-A1 METHOD FOR PRODUCING POLYCARBONATE SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 2006-06-14 EP claimed
EP-1349894-B1 POLYCARBONATE-POLYESTER COMPOSITIONS WITH ENHANCED FLOW GEN ELECTRIC (US) 2005-09-28 EP claimed
US-20050090638-A1 Method for producing polycarbonate SHELL OIL COMPANY 2005-04-28 US claimed
WO-2005026235-A1 METHOD FOR PRODUCING POLYCARBONATE SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2005-03-24 WO claimed
EP-1349894-A2 POLYCARBONATE-POLYESTER COMPOSITIONS WITH ENHANCED FLOW GENERAL ELECTRIC COMPANY (US) 2003-10-08 EP claimed
US-6599966-B2 Containing phosphonium sulfonate additive GENERAL ELECTRIC COMPANY 2003-07-29 US claimed
US-20020132889-A1 Polycarbonate-polyester compositions with enhanced flow SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2002-09-19 US claimed
WO-2002048263-A2 POLYCARBONATE-POLYESTER COMPOSITIONS WITH ENHANCED FLOW GENERAL ELECTRIC COMPANY (US) 2002-06-20 WO claimed
CN-108473672-B Process for preparing melt polycarbonate 国际壳牌研究有限公司 2020-12-08 CN disclosed
US-10654973-B2 Method for producing polycarbonate SHELL OIL COMPANY (US) 2020-05-19 US disclosed
US-10640609-B2 Method for preparing a melt polycarbonate SHELL OIL COMPANY (US) 2020-05-05 US disclosed
US-20020132889-A1 Polycarbonate-polyester compositions with enhanced flow SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2002-09-19 US disclosed
WO-2002048263-A2 POLYCARBONATE-POLYESTER COMPOSITIONS WITH ENHANCED FLOW GENERAL ELECTRIC COMPANY (US) 2002-06-20 WO disclosed
CN-1137788-A Process for making polyphenols from ketones or aldehydes and phenols DOW CHEMICAL CO (US) 1996-12-11 CN 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-10640609-B2 Method for preparing a melt polycarbonate PKD1, HSD17B7, DHCR7 NR5A1 668/4885KDM4E 2688/4885ALDH1A1 4008/4885

“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.