SCHEMBL2536166

SCHEMBL2536166

C#Cc1ccc(O)c(C(=O)O)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 3/20 0.62
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
PTGS2 P35354 2/20 0.55
CA12 O43570 1/20 0.55
ALOX5 P09917 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
KDR P35968 2/20 0.55
PDE4A P27815 1/20 0.55
BLVRB P30043 1/20 0.55
HTT P42858 1/20 0.55
TDP1 Q9NUW8 3/20 0.52
KDM4E B2RXH2 3/20 0.52
ALDH1A1 P00352 3/20 0.52
HPGD P15428 3/20 0.52
HSD17B10 Q99714 3/20 0.52

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
SCHEMBL7615611 0.84 ALDH1A1 (0.55) HNF4ACA1CA2CA12CA7
SCHEMBL541999 0.83 HNF4A (0.43) HNF4ACA1CA2PTGS2CA12
Hydrochloric Acid SCHEMBL6732842 0.82 HNF4A (0.42) HNF4ACA1CA2PTGS2CA12
SCHEMBL2747715 0.82 F2 (0.44) HNF4ACA1CA2PTGS2ALDH1A1
SCHEMBL131551 0.80 HNF4A (0.62) HNF4ACA1CA2PTGS2CA12
SCHEMBL30902488 0.80 HNF4A (0.62) HNF4ACA1CA2PTGS2CA12
SCHEMBL689828 0.80 HNF4A (0.41) HNF4APTGS2MEN1KMT2AKDR
SCHEMBL30828728 0.79 HNF4A (0.61) HNF4ACA1CA2PTGS2CA12
SCHEMBL1783561 0.78 ALDH1A1 (0.57) HNF4AMEN1KMT2ATDP1KDM4E
SCHEMBL20564443 0.78 CYP3A4 (0.40) HNF4APTGS2KDM4ECYP3A4

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
EP-2394980-B1 AROMATIC AMINO COMPOUND MANUFACTURING METHOD HODOGAYA CHEMICAL CO LTD (JP) 2016-12-21 EP disclosed
US-9238624-B2 Method of producing aromatic amino compounds HODOGAYA CHEMICAL CO., LTD. (JP) 2016-01-19 US disclosed
US-20140163232-A1 METHOD OF PRODUCING AROMATIC AMINO COMPOUNDS HODOGAYA CHEMICAL CO., LTD. (JP) 2014-06-12 US disclosed
US-8735626-B2 Method of producing aromatic amino compounds HODOGAYA CHEMICAL CO., LTD. (JP) 2014-05-27 US disclosed
EP-2394980-A1 AROMATIC AMINO COMPOUND MANUFACTURING METHOD Hodogaya Chemical Co., Ltd. (JP) 2011-12-14 EP disclosed
CN-102239133-A Aromatic amino compound manufacturing method HODOGAYA CHEMICAL CO LTD 2011-11-09 CN disclosed
US-20110257404-A1 METHOD OF PRODUCING AROMATIC AMINO COMPOUNDS HODOGAYA CHEMICAL CO., LTD. (JP) 2011-10-20 US disclosed
US-7833335-B2 Ink-jet ink sets HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2010-11-16 US disclosed
US-20080252681-A1 Ink-jet ink sets HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2008-10-16 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 (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-20140163232-A1 METHOD OF PRODUCING AROMATIC AMINO COMPOUNDS DDC, AOC2, AOC3 HNF4A 2672/4885CA1 665/4885CA2 1239/4885
US-20110257404-A1 METHOD OF PRODUCING AROMATIC AMINO COMPOUNDS AOC2, AOC3, DDC HNF4A 3115/4885CA1 1873/4885CA2 2454/4885

“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.