SCHEMBL3709147

SCHEMBL3709147

CCC(=O)c1ccc(OC)cc1O.CCC(=O)c1ccc(OC)cc1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.68
RAB9A P51151 5/20 0.68
HSP90AB1 P08238 1/20 0.68
HPGD P15428 5/20 0.66
CYP3A4 P08684 4/20 0.66
ALDH1A1 P00352 3/20 0.66
MAPK1 P28482 3/20 0.66
KMT2A Q03164 4/20 0.61
MEN1 O00255 3/20 0.61
MAPT P10636 2/20 0.61
SMN1; SMN2 Q16637 3/20 0.60
ATM Q13315 1/20 0.60
HMGCR P04035 1/20 0.59
LMNA P02545 4/20 0.58
CYP2C19 P33261 3/20 0.58
CYP1A2 P05177 2/20 0.58
PGR P06401 2/20 0.58
SLC6A2 P23975 2/20 0.58
ADORA3 P0DMS8 1/20 0.58
AR P10275 1/20 0.58

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
SCHEMBL38652178 1.00 NPC1 (0.68) NPC1RAB9AHSP90AB1HPGDCYP3A4
SCHEMBL2260356 1.00 NPC1 (0.68) NPC1RAB9AHSP90AB1HPGDCYP3A4
SCHEMBL5477586 0.87 NPC1 (0.70) NPC1RAB9AHPGDCYP3A4ALDH1A1
SCHEMBL3658652 0.86 NPC1 (0.64) NPC1RAB9AHSP90AB1HPGDCYP3A4
SCHEMBL8665984 0.86 NPC1 (0.63) NPC1RAB9AHSP90AB1HPGDCYP3A4
SCHEMBL28085535 0.85 NPC1 (0.53) NPC1RAB9AHSP90AB1HPGDCYP3A4
SCHEMBL3048417 0.84 NPC1 (0.66) NPC1RAB9AHPGDCYP3A4ALDH1A1
SCHEMBL30263100 0.84 NPC1 (0.66) NPC1RAB9AHPGDCYP3A4ALDH1A1
SCHEMBL1938819 0.84 NPC1 (0.68) NPC1RAB9AHPGDCYP3A4ALDH1A1
SCHEMBL5624874 0.84 RAB9A (0.66) NPC1RAB9AHPGDCYP3A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9364424-B2 Topical cosmetic skin lightening compositions and methods of use thereof STIEFEL LABORATORIES, INC. (US) 2016-06-14 US disclosed
US-20160074315-A1 TOPICAL COSMETIC SKIN LIGHTENING COMPOSITIONS AND METHODS OF USE THEREOF STIEFEL LABORATORIES, INC. 2016-03-17 US disclosed
EP-2219600-A1 TOPICAL COSMETIC SKIN LIGHTENING COMPOSITIONS AND METHODS OF USE THEREOF STIEFEL LABORATORIES, INC. (US) 2010-08-25 EP disclosed
WO-2009067095-A1 TOPICAL COSMETIC SKIN LIGHTENING COMPOSITIONS AND METHODS OF USE THEREOF STIEFEL LABORATORIES, INC. (US) 2009-05-28 WO disclosed
EP-1602354-B1 Use of polyglutamic acid or its salts MEIJI SEIKA KAISHA (JP) 2008-11-05 EP disclosed
EP-1604647-B1 Cosmetic composition containing polyorganosiloxane-containing epsilon-polylysine polymer, and polyhydric alcohol, and production thereof CHISSO CORP (JP) 2008-05-07 EP disclosed
US-20060165636-A1 Hair treatment composition and hair cosmetic for damaged hair MEIJI SEIKA KAISHA, LTD. (JP) 2006-07-27 US disclosed
US-20060018867-A1 Cosmetic composition and production thereof ICHIMARU PHARCOS CO., LTD 2006-01-26 US disclosed
EP-1604647-A1 Cosmetic composition containing polyorganosiloxane-containing epsilon-polylysine polymer, and polyhydric alcohol, and production thereof Ichimaru Pharcos Co., Ltd. (JP) 2005-12-14 EP disclosed
EP-1602354-A1 HAIR TREATMENT COMPOSITION AND HAIR COSMETIC FOR DAMAGED HAIR Meiji Seika Kaisha, Ltd. (JP) 2005-12-07 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 (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-20060165636-A1 Hair treatment composition and hair cosmetic for damaged hair CUTA, COL14A1, PRKDC NPC1 4845/4885RAB9A 3880/4885HSP90AB1 1489/4885
US-20060018867-A1 Cosmetic composition and production thereof CUTA, PARG, TYR NPC1 3666/4885RAB9A 1846/4885HSP90AB1 4254/4885

“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.