SCHEMBL3267828

SCHEMBL3267828

O=Cc1cc(C(=O)O)cc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
ALDH1A1 P00352 4/20 0.48
HPGD P15428 3/20 0.48
HSD17B10 Q99714 2/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP1A2 P05177 1/20 0.48
GLA P06280 1/20 0.48
CYP2C19 P33261 1/20 0.48
PTPN1 P18031 1/20 0.46
ERN1 O75460 3/20 0.44
NPC1 O15118 1/20 0.43
GAA P10253 1/20 0.43
RAB9A P51151 1/20 0.43
GRIN2D O15399 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2C Q14957 1/20 0.42
MAPT P10636 2/20 0.42
MGAM O43451 1/20 0.42
UNG P13051 1/20 0.42

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
SCHEMBL7542003 0.89 PTPN1 (0.45) MEN1KMT2AALDH1A1HPGDHSD17B10
SCHEMBL1506785 0.84 MEN1 (0.47) MEN1KMT2AALDH1A1HPGDHSD17B10
SCHEMBL28371598 0.84 ALDH1A1 (0.57) MEN1KMT2AALDH1A1HPGDHSD17B10
SCHEMBL9670483 0.81 PTPN1 (0.62) MEN1KMT2AALDH1A1HPGDPTPN1
SCHEMBL3272215 0.80 ERN1 (0.50) ALDH1A1HPGDKDM4EERN1TSHR
SCHEMBL3268830 0.79 KDM2B (0.45) MEN1KMT2AERN1RAB9A
SCHEMBL7537287 0.79 ALDH1A1 (0.41) MEN1KMT2AALDH1A1HPGDHSD17B10
Benzoic Acid SCHEMBL27844693 0.79 NPC1 (0.54) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL3388906 0.78 PTGER4 (0.54) MEN1KMT2AALDH1A1HPGDHSD17B10
SCHEMBL7544129 0.78 ERN1 (0.38) MEN1KMT2AALDH1A1HPGDHSD17B10

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
EP-1914229-B1 NOVEL CERCOSPORAMIDE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2010-06-16 EP disclosed
US-20090036492-A1 Novel Cercosporamide Derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-02-05 US disclosed
EP-1914229-A1 NOVEL CERCOSPORAMIDE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2008-04-23 EP disclosed
EP-0802896-B1 METHOD FOR PURIFYING CRUDE NAPHTHALENEDICARBOXYLIC ACID MITSUI CHEMICALS INC (JP) 2001-01-03 EP disclosed
US-5872284-A CATALYTIC HYDROGENATION OF 2,6-NAPHTHALENEDICARBOXYLIC ACID COMPOUNDS IN WATER AND SOLVENT MITSUI CHEMICALS, INC. (JP) 1999-02-16 US disclosed
EP-0802896-A1 METHOD FOR PURIFYING CRUDE NAPHTHALENEDICARBOXYLIC ACID MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-10-29 EP disclosed
WO-1997017318-A1 METHOD FOR PURIFYING CRUDE NAPHTHALENEDICARBOXYLIC ACID MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-05-15 WO disclosed
US-5155113-A Administering 5-fluorouracil and derivatives with pyridine and pyridone derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-10-13 US disclosed
EP-0180188-B1 A COMPOSITION FOR INCREASING THE ANTI-CANCER ACTIVITY OF AN ANTI-CANCER COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-04-15 EP disclosed
EP-0180188-A2 A composition for increasing the anti-cancer activity of an anti-cancer compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-05-07 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 (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-20090036492-A1 Novel Cercosporamide Derivative GPR119, CBR3, SLC5A2 MEN1 1138/4885KMT2A 2352/4885ALDH1A1 381/4885

“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.