SCHEMBL4653545

SCHEMBL4653545

O=C(O)c1cccc(OCCCCCCCCCCCCO)c1

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.69
PLA2G4B P0C869 1/20 0.62
NR4A2 P43354 3/20 0.59
PRSS1 P07477 5/20 0.57
NR1H4 Q96RI1 3/20 0.56
SMPD1 P17405 3/20 0.55
AKR1C3 P42330 1/20 0.54
POLB P06746 1/20 0.53

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
SCHEMBL4799598 1.00 KMT2A (0.69) KMT2APLA2G4BNR4A2PRSS1NR1H4
SCHEMBL4509654 0.93 KMT2A (0.77) KMT2APLA2G4BNR4A2PRSS1NR1H4
SCHEMBL9803295 0.91 KMT2A (0.80) KMT2APLA2G4BNR4A2PRSS1NR1H4
SCHEMBL8517907 0.90 KMT2A (0.73) KMT2APLA2G4BNR4A2NR1H4AKR1C3
SCHEMBL30167982 0.88 KMT2A (0.80) KMT2APLA2G4BNR4A2PRSS1NR1H4
SCHEMBL10787479 0.88 KMT2A (0.80) KMT2APLA2G4BNR4A2PRSS1NR1H4
SCHEMBL201793 0.87 PRSS1 (0.62) KMT2APRSS1SMPD1
SCHEMBL9402647 0.86 KMT2A (0.73) KMT2APLA2G4BNR4A2PRSS1NR1H4
SCHEMBL2887568 0.85 KMT2A (0.82) KMT2APLA2G4BNR1H4SMPD1
SCHEMBL8086388 0.85 KMT2A (0.82) KMT2APLA2G4BNR1H4SMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
WO-1996017589-A1 METHOD OF SMOOTHING OR REMOVING WRINKLES AND METHOD OF STIMULATING COLLAGEN SYNTHESIS KAO CORPORATION (JP) 1996-06-13 WO 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 KMT2A 998/4885PLA2G4B 4685/4885NR4A2 4434/4885
US-20060018867-A1 Cosmetic composition and production thereof CUTA, PARG, TYR KMT2A 847/4885PLA2G4B 1586/4885NR4A2 4849/4885

“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.