SCHEMBL5014948

SCHEMBL5014948

NC(=O)c1c(O)ccc2cc(-c3ccccc3)ccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.55
ESR2 Q92731 3/20 0.55
ERN1 O75460 4/20 0.52
HSD17B1 P14061 3/20 0.50
HSD17B2 P37059 3/20 0.50
CYP1A2 P05177 2/20 0.50
CYP3A4 P08684 2/20 0.50
CYP2D6 P10635 2/20 0.50
CYP2C9 P11712 2/20 0.50
CYP2B6 P20813 2/20 0.50
CYP2C19 P33261 2/20 0.50
LCK P06239 1/20 0.48
ACMSD Q8TDX5 3/20 0.47
DHFR P00374 1/20 0.47
HNF4A P41235 1/20 0.47
MCL1 Q07820 1/20 0.47
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL28866383 0.87 ESR1 (0.58) ESR1ESR2ERN1HSD17B1HSD17B2
SCHEMBL5023242 0.80 PDE4A (0.44) HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6
SCHEMBL7049899 0.79 GRIN2D (0.49) ESR1ESR2ERN1HSD17B1HSD17B2
SCHEMBL1803539 0.78 ABCG2 (0.54) ERN1CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL5016685 0.77 CFD (0.46) ESR1ESR2ERN1KDM4EMEN1
SCHEMBL3010060 0.77 HSD17B1 (0.64) ESR1ESR2ERN1HSD17B1HSD17B2
SCHEMBL10950376 0.77 PLAU (0.50) ESR2ERN1HSD17B1HSD17B2CYP1A2
SCHEMBL11430028 0.76 ESR2 (0.65) ESR1ESR2HSD17B1HSD17B2CYP1A2
SCHEMBL5302383 0.76 ESR2 (0.81) ESR1ESR2HSD17B1HSD17B2CYP1A2
SCHEMBL30944686 0.76 ESR2 (0.81) ESR1ESR2HSD17B1HSD17B2CYP1A2

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
US-7449608-B2 Naphthol derivative and charge control agent comprising the same UENO FINE CHEMICALS INDUSTRY, LTD. (JP) 2008-11-11 US disclosed
CN-1289468-C Naphthol derivative and charge control agent comprising the same UENO SEIYAKU OYO KENKYUJO KK (JP) 2006-12-13 CN disclosed
CN-1217940-C Naphthol derivatives UENO SEIYAKU OYO KENKYUJO KK (JP) 2005-09-07 CN disclosed
US-20050119487-A1 Naphthol derivative and charge control agent comprising the same KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 2005-06-02 US disclosed
CN-1617851-A Naphthol derivative and charge control agent comprising the same UENO SEIYAKU OYO KENKYUJO KK (JP) 2005-05-18 CN disclosed
EP-1462440-A1 NAPHTHOL DERIVATIVE AND CHARGE CONTROL AGENT COMPRISING THE SAME Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 2004-09-29 EP disclosed
CN-1386120-A Naphthol derivatives UENO SEIYAKU OYO KENKYUJO KK (JP) 2002-12-18 CN 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 (1 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-20050119487-A1 Naphthol derivative and charge control agent comprising the same CECR2, PEF1, NAP1L1 ESR1 2983/4885ESR2 3607/4885ERN1 2537/4885

“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.