SCHEMBL688718

SCHEMBL688718

CCOc1ccc(C=CC(=O)Oc2ccccc2C)cc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.58
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
MAPT P10636 2/20 0.58
MAOB P27338 8/20 0.54
MAOA P21397 1/20 0.54
RELA Q04206 1/20 0.51
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 2/20 0.51
HTT P42858 1/20 0.51
EGFR P00533 1/20 0.51
ABCG2 Q9UNQ0 1/20 0.50
MEN1 O00255 1/20 0.50
TP53 P04637 1/20 0.50
HPGD P15428 1/20 0.50
CASP7 P55210 1/20 0.50
HSD17B10 Q99714 1/20 0.50
SLC5A1 P13866 1/20 0.48
SLC5A2 P31639 1/20 0.48

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
SCHEMBL12010094 1.00 KMT2A (0.58) KMT2ANPC1RAB9AMAPTMAOB
SCHEMBL10037013 0.85 KMT2A (0.59) KMT2AMAPTMAOBRELAKDM4E
SCHEMBL689212 0.85 KMT2A (0.59) KMT2AMAPTMAOBRELAKDM4E
SCHEMBL29555131 0.85 KMT2A (0.59) KMT2AMAPTMAOBRELAKDM4E
SCHEMBL20024204 0.83 LMNA (0.56) KMT2ANPC1RAB9AMAPTALDH1A1
SCHEMBL17576048 0.83 LMNA (0.56) KMT2ANPC1RAB9AMAPTALDH1A1
SCHEMBL20031124 0.82 CA12 (0.57) KMT2ARAB9AMAPTMAOBRELA
SCHEMBL14588238 0.82 MAOB (0.72) KMT2ANPC1RAB9AMAPTMAOB
SCHEMBL31109263 0.80 CA12 (0.58) KMT2ANPC1RAB9AMAPTMAOB
SCHEMBL1959915 0.80 CA12 (0.71) KMT2ANPC1RAB9AMAPTMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180200170-A1 SUNSCREEN FORMULATIONS OPTIMIZED FOR THE FORMATION OF VITAMIN D UV-TECHNIK (DE) 2018-07-19 US disclosed
US-20160067158-A1 AGENTS CONTAINING LARGE QUANTITIES OF UV STABILIZERS BASF SE (DE) 2016-03-10 US disclosed
CN-101808976-B Ultraviolet absorber LEAD CHEM CO LTD 2013-03-20 CN disclosed
US-8252273-B2 Ultraviolet absorber LEAD CHEMICAL CO., LTD. (JP) 2012-08-28 US disclosed
EP-2192106-B1 ULTRAVIOLET ABSORBER LEAD CHEM CO LTD (JP) 2012-02-29 EP disclosed
US-20100239508-A1 ULTRAVIOLET ABSORBER LEAD CHEMICAL CO., LTD. (JP) 2010-09-23 US disclosed
CN-101808976-A ultraviolet absorber LEAD CHEM CO LTD 2010-08-18 CN disclosed
EP-2192106-A1 ULTRAVIOLET ABSORBER Lead Chemical Co. Ltd. (JP) 2010-06-02 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 (3 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-20160067158-A1 AGENTS CONTAINING LARGE QUANTITIES OF UV STABILIZERS ERCC5, ERCC1, TTPA KMT2A 3804/4885NPC1 962/4885RAB9A 2642/4885
US-20100239508-A1 ULTRAVIOLET ABSORBER UNG, UACA, ABCG2 KMT2A 4596/4885NPC1 2126/4885RAB9A 2817/4885
US-20180200170-A1 SUNSCREEN FORMULATIONS OPTIMIZED FOR THE FORMATION OF VITAMIN D VDR, CYP2R1, CYP24A1 KMT2A 4636/4885NPC1 4527/4885RAB9A 2467/4885

“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.