SCHEMBL4582464

SCHEMBL4582464

O=C(OCCc1ccccc1)c1ccnc(C(=O)OCCc2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.57
ESR1 P03372 1/20 0.56
ESR2 Q92731 1/20 0.56
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
TP53 P04637 1/20 0.48
GLA P06280 1/20 0.48
CYP3A4 P08684 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
HIF1A Q16665 1/20 0.48
HSD17B10 Q99714 1/20 0.48
KDM5B Q9UGL1 2/20 0.46
JMJD6 Q6NYC1 1/20 0.45
MMP1 P03956 1/20 0.45
MMP2 P08253 1/20 0.45

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
SCHEMBL8945534 0.85 TDP1 (0.60) L3MBTL1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL27665138 0.82 ESR1 (0.54) L3MBTL1ESR1ESR2NPC1RAB9A
SCHEMBL9561789 0.81 TSHR (0.47) NPC1RAB9AALDH1A1CYP3A4TSHR
SCHEMBL19439130 0.80 ESR1 (0.69) L3MBTL1ESR1ESR2NPC1RAB9A
SCHEMBL27327003 0.80 L3MBTL1 (0.69) L3MBTL1ESR1ESR2NPC1RAB9A
Bromide SCHEMBL29099292 0.79 ESR1 (0.67) L3MBTL1ESR1ESR2NPC1RAB9A
SCHEMBL8406007 0.79 JMJD6 (0.59) L3MBTL1ESR1NPC1RAB9ASMN1; SMN2
SCHEMBL8945290 0.78 TDP1 (0.58) NPC1RAB9ASMN1; SMN2ALDH1A1TDP1
SCHEMBL8945285 0.78 KDM5A (0.56) SMN1; SMN2ALDH1A1TDP1TSHRKDM5B
SCHEMBL9345772 0.78 SMN1; SMN2 (0.50) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11045407-B2 Process for treating keratin fibres with a pyridinedicarboxylic acid compound L'OREAL (FR) 2021-06-29 US disclosed
US-10857087-B2 Process for treating keratin fibres with a polysaccharide and a pyridinedi-carboxylic acid compound L'OREAL (FR) 2020-12-08 US disclosed
WO-2016142635-A1 METHOD FOR THE COSMETIC TREATMENT OF THICK HAIR WITH A PYRIDINE DICARBOXYLIC ACID COMPOUND L'OREAL (FR) 2016-09-15 WO disclosed
US-20160228346-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A POLYSACCHARIDE AND A PYRIDINEDI-CARBOXYLIC ACID COMPOUND L'OREAL (FR) 2016-08-11 US disclosed
US-20160228346-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A POLYSACCHARIDE AND A PYRIDINEDI-CARBOXYLIC ACID COMPOUND L'OREAL (FR) 2016-08-11 US disclosed
US-20160213587-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A PYRIDINEDICARBOXYLIC ACID COMPOUND L'OREAL (FR) 2016-07-28 US disclosed
US-20160213587-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A PYRIDINEDICARBOXYLIC ACID COMPOUND L'OREAL (FR) 2016-07-28 US disclosed
WO-2015036476-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A POLYSACCHARIDE AND A PYRIDINEDI-CARBOXYLIC ACID COMPOUND L'OREAL (FR) 2015-03-19 WO disclosed
WO-2015036477-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A PYRIDINEDICARBOXYLIC ACID COMPOUND L'OREAL (FR) 2015-03-19 WO disclosed
EP-1911438-A2 Cosmetic composition containing a derivative of dibenzoylmethane and a arylalkyl amide or ester compound; method of photostabilising the derivative of dibenzoylmethane L'Oréal (FR) 2008-04-16 EP disclosed
EP-1911438-A2 Cosmetic composition containing a derivative of dibenzoylmethane and a arylalkyl amide or ester compound; method of photostabilising the derivative of dibenzoylmethane L'Oréal (FR) 2008-04-16 EP disclosed
US-20080019930-A1 Dibenzoylmethane sunscreens photostabilized with arylalkyl amide or ester compounds L'OREAL (FR) 2008-01-24 US disclosed
US-20080019930-A1 Dibenzoylmethane sunscreens photostabilized with arylalkyl amide or ester compounds L'OREAL (FR) 2008-01-24 US 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-20080019930-A1 Dibenzoylmethane sunscreens photostabilized with arylalkyl amide or ester compounds TYR, DDT, AADAC L3MBTL1 3294/4885ESR1 779/4885ESR2 805/4885
US-11045407-B2 Process for treating keratin fibres with a pyridinedicarboxylic acid compound KRT18, CUTA, HKDC1 L3MBTL1 4850/4885ESR1 4338/4885ESR2 4374/4885
US-20160228346-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A POLYSACCHARIDE AND A PYRIDINEDI-CARBOXYLIC ACID COMPOUND KRT18, HKDC1, PHYKPL L3MBTL1 4883/4885ESR1 4541/4885ESR2 4575/4885
US-20160213587-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A PYRIDINEDICARBOXYLIC ACID COMPOUND KRT18, CUTA, HKDC1 L3MBTL1 4850/4885ESR1 4338/4885ESR2 4374/4885
US-10857087-B2 Process for treating keratin fibres with a polysaccharide and a pyridinedi-carboxylic acid compound KRT18, HKDC1, PHYKPL L3MBTL1 4883/4885ESR1 4541/4885ESR2 4575/4885

“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.