SCHEMBL138012

SCHEMBL138012

Cc1ccc2cc(C(C)Nc3ccc(-c4ccoc4C(=O)NNC(=O)c4ccc(O)c([N+](=O)[O-])c4)cc3)ccc2c1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GCGR P47871 2/20 0.57
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
AURKB Q96GD4 1/20 0.34
MAPT P10636 2/20 0.34
MAPK1 P28482 1/20 0.34
POLB P06746 1/20 0.33
ALDH1A1 P00352 2/20 0.33

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
SCHEMBL142557 0.93 GCGR (0.57) GCGRMEN1KMT2AAURKBMAPT
SCHEMBL143135 0.93 GCGR (0.61) GCGRMEN1KMT2AAURKBMAPT
SCHEMBL138764 0.93 GCGR (0.61) GCGRMEN1KMT2AAURKBMAPT
Hydrochloric Acid SCHEMBL142406 0.92 GCGR (0.60) GCGRMEN1KMT2AAURKBMAPT
SCHEMBL138686 0.91 GCGR (0.58) GCGRMEN1KMT2AAURKBMAPT
SCHEMBL139350 0.90 GCGR (0.59) GCGRMEN1KMT2AAURKBMAPT
SCHEMBL16222873 0.90 GCGR (0.59) GCGRMEN1KMT2AAURKBMAPT
SCHEMBL141633 0.88 GCGR (0.61) GCGRAURKBMAPTALDH1A1
SCHEMBL139787 0.88 GCGR (0.61) GCGRAURKBMAPTALDH1A1
SCHEMBL135593 0.88 GCGR (0.57) GCGRMEN1KMT2AAURKBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2431362-A1 3-(4-AMINOPHENYL)-2-FURANCARBOXYLIC ACID DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-03-21 EP claimed
US-20120059012-A1 3-(4-AMINOPHENYL)-2-FURANCARBOXYLIC ACID DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-03-08 US claimed
US-8883824-B2 3-(4-aminophenyl)-2-furancarboxylic acid derivative and pharmaceutically acceptable salt thereof SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2014-11-11 US disclosed
EP-2431362-A1 3-(4-AMINOPHENYL)-2-FURANCARBOXYLIC ACID DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-03-21 EP disclosed
US-20120059012-A1 3-(4-AMINOPHENYL)-2-FURANCARBOXYLIC ACID DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-03-08 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 (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-20120059012-A1 3-(4-AMINOPHENYL)-2-FURANCARBOXYLIC ACID DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ACSL3, SLCO4C1, SLC38A7 GCGR 4122/4885MEN1 945/4885KMT2A 3908/4885

“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.