SCHEMBL710348

SCHEMBL710348

CCOC(=O)Cc1cc(C(=O)c2ccc(S(=O)(=O)N3CCN(C(=O)OCC)CC3)cc2)c2cc(F)ccc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.55
HSD17B10 Q99714 2/20 0.55
TP53 P04637 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
SMN1; SMN2 Q16637 4/20 0.51
KMT2A Q03164 4/20 0.51
ALDH1A1 P00352 3/20 0.51
MEN1 O00255 3/20 0.51
MAPT P10636 3/20 0.51
LMNA P02545 3/20 0.51
KDM4E B2RXH2 2/20 0.51
ESR1 P03372 1/20 0.51
HPGD P15428 1/20 0.51
PKM P14618 2/20 0.50
POLB P06746 2/20 0.48
PTGDR2 Q9Y5Y4 2/20 0.47
L3MBTL1 Q9Y468 2/20 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
SCHEMBL708235 0.93 PTGDR2 (0.56) USP2HSD17B10TP53CYP1A2CYP3A4
SCHEMBL709916 0.92 CYP2C9 (0.52) USP2HSD17B10TP53CYP1A2CYP3A4
SCHEMBL708417 0.90 PTGDR2 (0.47) USP2HSD17B10TP53CYP1A2CYP3A4
SCHEMBL709968 0.84 PTGDR2 (0.45) HSD17B10CYP1A2CYP3A4KMT2AMEN1
SCHEMBL716116 0.83 PTGDR2 (0.52) USP2HSD17B10TP53CYP1A2CYP3A4
SCHEMBL2169900 0.82 PTGDR2 (0.56) USP2KMT2AMEN1PTGDR2
SCHEMBL709881 0.81 PTGDR2 (0.58) USP2CYP2C9SMN1; SMN2ALDH1A1LMNA
SCHEMBL709895 0.78 PTGDR2 (0.58) SMN1; SMN2KMT2AALDH1A1MEN1MAPT
SCHEMBL27823482 0.78 PTGDR2 (0.44) CYP1A2CYP3A4CYP2C19ALDH1A1PKM
SCHEMBL13354043 0.77 MAOB (0.39) HSD17B10TP53CYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124629-B2 Naphthylacetic acids HOFFMANN-LA ROCHE INC. (US) 2012-02-28 US disclosed
US-8124629-B2 Naphthylacetic acids HOFFMANN-LA ROCHE INC. (US) 2012-02-28 US disclosed
US-8124629-B2 Naphthylacetic acids HOFFMANN-LA ROCHE INC. (US) 2012-02-28 US disclosed
EP-2346807-A1 NAPHTHYLACETIC ACIDS F. Hoffmann-La Roche AG (CH) 2011-07-27 EP disclosed
US-20100137250-A1 NAPHTHYLACETIC ACIDS FIROOZNIA FARIBORZ 2010-06-03 US disclosed
US-20100137250-A1 NAPHTHYLACETIC ACIDS FIROOZNIA FARIBORZ 2010-06-03 US disclosed
US-20100137250-A1 NAPHTHYLACETIC ACIDS FIROOZNIA FARIBORZ 2010-06-03 US disclosed
WO-2010055005-A1 NAPHTHYLACETIC ACIDS F. HOFFMANN-LA ROCHE AG (CH) 2010-05-20 WO disclosed
WO-2010055005-A1 NAPHTHYLACETIC ACIDS F. HOFFMANN-LA ROCHE AG (CH) 2010-05-20 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 (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-20100137250-A1 NAPHTHYLACETIC ACIDS HRH2, HRH1, HRH3 USP2 3106/4885HSD17B10 1551/4885TP53 4148/4885

“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.