SCHEMBL3003131

SCHEMBL3003131

COC(CC(C)C)(C(=O)c1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.50
SRC P12931 1/20 0.46
TSHR P16473 1/20 0.41
KMT2A Q03164 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
GAA P10253 1/20 0.40
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
MLYCD O95822 1/20 0.38
POLB P06746 3/20 0.38
LMNA P02545 2/20 0.38
PGR P06401 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
HTR2A P28223 1/20 0.38
HRH1 P35367 1/20 0.38
KCNH2 Q12809 1/20 0.38
NPSR1 Q6W5P4 2/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL8462452 0.77 CES1 (0.45) CES1SRCTSHRKMT2AL3MBTL1
SCHEMBL4953088 0.75 SMN1; SMN2 (0.45) CES1SRCTSHRKMT2AL3MBTL1
SCHEMBL1264958 0.75 CES1 (0.44) CES1SRCTSHRKMT2ASMN1; SMN2
SCHEMBL15651 0.75 CES1 (0.49) CES1SRCTSHRKMT2AL3MBTL1
SCHEMBL28189546 0.75 SRC (0.57) CES1SRCTSHRKMT2ASMN1; SMN2
SCHEMBL6763904 0.74 CES1 (0.47) CES1SRCSMN1; SMN2GAAMLYCD
Methane SCHEMBL16506198 0.73 CES1 (0.47) CES1SRCTSHRKMT2AL3MBTL1
SCHEMBL2124071 0.73 CES1 (0.47) CES1SRCTSHRKMT2AL3MBTL1
SCHEMBL31328399 0.73 CES1 (0.47) CES1SRCTSHRKMT2AL3MBTL1
SCHEMBL4591841 0.73 CES1 (0.47) CES1SRCGAALMNAKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3536308-A1 SKIN CARE PREPARATIONS Nisshinbo Holdings Inc. (JP) 2019-09-11 EP disclosed
US-20190254938-A1 SKIN COSMETICS NISSHINBO HOLDINGS INC. (JP) 2019-08-22 US disclosed
EP-3185850-A1 SKIN COLOR-IMPROVING AGENT AND COMPOSITION FOR IMPROVING SKIN COLOR Showa Denko K.K. (JP) 2017-07-05 EP disclosed
EP-2832727-B1 NOVEL BENZYLIDENE AZOLIDINE DERIVATIVE OR SALT THEREOF ROHTO PHARMA (JP) 2016-09-07 EP disclosed
US-9422246-B2 Benzylidene azolidine derivative or salt thereof ROHTO PHARMACEUTICAL CO., LTD. (JP) 2016-08-23 US disclosed
WO-2016031634-A1 SKIN COLOR-IMPROVING AGENT AND COMPOSITION FOR IMPROVING SKIN COLOR SHOWA DENKO K. K. (JP) 2016-03-03 WO disclosed
US-20150065728-A1 NOVEL BENZYLIDENE AZOLIDINE DERIVATIVE OR SALT THEREOF ROHTO PHARMACEUTICAL CO., LTD. (JP) 2015-03-05 US disclosed
EP-2832727-A1 NOVEL BENZYLIDENE AZOLIDINE DERIVATIVE OR SALT THEREOF Rohto Pharmaceutical Co., Ltd. (JP) 2015-02-04 EP disclosed
EP-2516510-A1 SURFACE-TREATMENT AGENT FOR POWDER FOR USE IN COSMETIC AND COSMETIC CONTAINING POWDER TREATED WITH THE SAME Dow Corning Toray Co., Ltd. (JP) 2012-10-31 EP disclosed
US-20100183529-A1 Cosmetic compositions comprising photostabilized dibenzoylmethane compounds and 2-pyrrolidinone-4- carboxy esters L'OREAL (FR) 2010-07-22 US disclosed
US-20070041922-A1 Compositions for Treating Keratinous Surfaces CITICORP USA, INC. 2007-02-22 US disclosed
US-20070020216-A1 Compositions for Treating Keratinous Surfaces REVLON CONSUMER PRODUCTS CORPORATION 2007-01-25 US disclosed
US-20050118124-A1 A foundation makeup, concealer, powder, eyeshadow, mascara, eyeliner, or blush with Acetyl Hexapeptide-3 as a primary ingredient; improved aging and wrinkle resistances CITICORP USA, INC. 2005-06-02 US disclosed
EP-0669323-B2 COSMETIC AND DERMATOLOGICAL PREPARATIONS, CONTAINING PHENYLENE-1,4-BISBENZIMIDAZOLE SULFONIC ACIDS HAARMANN & REIMER GMBH (DE) 2004-04-07 EP disclosed
EP-0669323-B1 COSMETIC AND DERMATOLOGICAL PREPARATIONS, CONTAINING PHENYLENE-1,4-BISBENZIMIDAZOLE SULFONIC ACIDS HAARMANN & REIMER GMBH (DE) 2001-05-09 EP disclosed
US-6037473-A AS SUNSCREENS IN COSMETIC AND PHARMACEUTICAL PREPARATIONS; FOR ENHANCING PHOTOSTABILITY OF INDUSTRIAL PRODUCTS SUCH AS PAINTS, VARNISHES, PLASTICS, TEXTILES, PACKAGING MATERIALS AND RUBBERS HAARMANN & REIMER GMBH (DE) 2000-03-14 US disclosed
US-5961960-A Use of substituted benzazoles as UV absorbers, new benzazoles and processes for their preparation HAARMANN & REIMER GMBH (DE) 1999-10-05 US disclosed
EP-0843995-A2 Use of substituted benzazoles as UV absorbents, new benzazoles and their preparation HAARMANN & REIMER GMBH (DE) 1998-05-27 EP disclosed
US-5585091-A SUNSCREEN AGENT HAARMANN & REIMER GMBH (DE) 1996-12-17 US disclosed
EP-0669323-A1 Utilization of benzazols as UV-absorbers, new benzazoles and process for their preparation HAARMANN & REIMER GMBH (DE) 1995-08-30 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 (5 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-20070020216-A1 Compositions for Treating Keratinous Surfaces KRT18, FN1, HKDC1 CES1 4549/4885SRC 4181/4885TSHR 3157/4885
US-20050118124-A1 A foundation makeup, concealer, powder, eyeshadow, mascara, eyeliner, or blush with Acetyl Hexapeptide-3 as a primary ingredient; improved aging and wrinkle resistances IGFBP3, MC3R, MC1R CES1 4010/4885SRC 4100/4885TSHR 1186/4885
US-20150065728-A1 NOVEL BENZYLIDENE AZOLIDINE DERIVATIVE OR SALT THEREOF IL4I1, SLC6A19, SLC9B2 CES1 4107/4885SRC 3449/4885TSHR 3860/4885
US-20070041922-A1 Compositions for Treating Keratinous Surfaces CUTA, KRT18, MCOLN2 CES1 4010/4885SRC 2578/4885TSHR 2257/4885
US-20100183529-A1 Cosmetic compositions comprising photostabilized dibenzoylmethane compounds and 2-pyrrolidinone-4- carboxy esters CYP1B1, C1S, DDT CES1 122/4885SRC 4033/4885TSHR 3085/4885

“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.