SCHEMBL4654829

SCHEMBL4654829

CC(C)=CCCC(C)=CCOc1cc(O)cc(C(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.47
GAA P10253 1/20 0.47
SI P14410 1/20 0.47
PTPN1 P18031 1/20 0.47
MGAM2 Q2M2H8 1/20 0.47
ALOX15 P16050 5/20 0.47
TDP1 Q9NUW8 2/20 0.47
ALDH1A1 P00352 2/20 0.47
MTNR1A P48039 2/20 0.47
KDM4E B2RXH2 1/20 0.47
NDUFS8 O00217 1/20 0.47
COXFA4 O00483 1/20 0.47
NDUFAB1 O14561 1/20 0.47
NDUFA1 O15239 1/20 0.47
NDUFS4 O43181 1/20 0.47
NDUFB5 O43674 1/20 0.47
NDUFB3 O43676 1/20 0.47
NDUFC1 O43677 1/20 0.47
NDUFA2 O43678 1/20 0.47
NDUFS5 O43920 1/20 0.47

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
SCHEMBL4654826 1.00 MGAM (0.47) MGAMGAASIPTPN1MGAM2
SCHEMBL6654666 0.92 ALOX15 (0.51) ALOX15TDP1ALDH1A1MTNR1AKDM4E
SCHEMBL6653790 0.92 ALOX15 (0.51) ALOX15TDP1ALDH1A1MTNR1AKDM4E
SCHEMBL4652347 0.85 TRPV1 (0.53) MGAMGAASIPTPN1MGAM2
SCHEMBL4652344 0.85 TRPV1 (0.53) MGAMGAASIPTPN1MGAM2
SCHEMBL24183242 0.85 ALOX15 (0.53) MGAMGAASIPTPN1MGAM2
SCHEMBL4653412 0.82 ALOX15 (0.53) ALOX15TDP1ALDH1A1MTNR1AKDM4E
SCHEMBL4653415 0.82 ALOX15 (0.53) ALOX15TDP1ALDH1A1MTNR1AKDM4E
SCHEMBL4652487 0.81 TRPV1 (0.56) ALOX15TDP1ALDH1A1MTNR1AKDM4E
SCHEMBL4652491 0.81 TRPV1 (0.56) ALOX15TDP1ALDH1A1MTNR1AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5646184-A SEBACEOUS SECRETION INHIBITORY ACTIVITY KAO CORPORATION (JP) 1997-07-08 US claimed
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
EP-0643035-B1 DERMATOLOGIC PREPARATION AND NOVEL BENZOIC ACID DERIVATIVE KAO CORP (JP) 1999-09-01 EP disclosed
US-5646184-A SEBACEOUS SECRETION INHIBITORY ACTIVITY KAO CORPORATION (JP) 1997-07-08 US disclosed
WO-1996017589-A1 METHOD OF SMOOTHING OR REMOVING WRINKLES AND METHOD OF STIMULATING COLLAGEN SYNTHESIS KAO CORPORATION (JP) 1996-06-13 WO disclosed
EP-0643035-A1 DERMATOLOGIC PREPARATION AND NOVEL BENZOIC ACID DERIVATIVE Kao Corporation (JP) 1995-03-15 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 MGAM 2516/4885GAA 842/4885SI 2384/4885
US-20060018867-A1 Cosmetic composition and production thereof CUTA, PARG, TYR MGAM 391/4885GAA 35/4885SI 621/4885

“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.