SCHEMBL2204199

SCHEMBL2204199

COc1ccc(Cl)cc1-c1cc(C(=O)O)cc(-n2cnnn2)c1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
MAPT P10636 1/20 0.48
F11 P03951 3/20 0.47
KLKB1 P03952 3/20 0.47
USP2 O75604 1/20 0.44
ERN1 O75460 1/20 0.44
PTGS2 P35354 2/20 0.44
ALDH1A1 P00352 3/20 0.43
HPGD P15428 3/20 0.43
TP53 P04637 1/20 0.43
EPHX2 P34913 1/20 0.41
STIM1 Q13586 1/20 0.41
ORAI1 Q96D31 1/20 0.41

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
SCHEMBL2204223 0.88 STIM1 (0.53) KMT2AMAPTPTGS2ALDH1A1HPGD
SCHEMBL2206505 0.87 KMT2A (0.44) KMT2AMEN1ERN1PTGS2ALDH1A1
SCHEMBL2203624 0.85 TP53 (0.48) KMT2APTGS2TP53EPHX2STIM1
SCHEMBL2206805 0.85 NOTUM (0.46) KMT2AMEN1F11KLKB1
SCHEMBL4331296 0.83 F2 (0.43) KMT2AMEN1F11USP2ALDH1A1
SCHEMBL358511 0.83 SRD5A2 (0.48) KMT2AMEN1F11
SCHEMBL2205182 0.81 RXFP1 (0.50) KMT2AERN1PTGS2ALDH1A1HPGD
SCHEMBL2204512 0.81 GAA (0.57) KMT2AMEN1MAPTALDH1A1TP53
SCHEMBL356937 0.81 NOTUM (0.43) KMT2AMEN1F11KLKB1
SCHEMBL2410383 0.81 ALDH1A1 (0.57) KMT2AMEN1USP2ERN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2205573-B1 TETRAZOLE-SUBSTITUTED ARYL AMIDE DERIVATIVES AND USES THEREOF HOFFMANN LA ROCHE (CH) 2013-10-23 EP claimed
EP-2205573-B1 TETRAZOLE-SUBSTITUTED ARYL AMIDE DERIVATIVES AND USES THEREOF HOFFMANN LA ROCHE (CH) 2013-10-23 EP disclosed
US-7981914-B2 Tetrazole-substituted aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2011-07-19 US disclosed
US-20090093523-A1 Tetrazole-substituted aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC 2009-04-09 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-20090093523-A1 Tetrazole-substituted aryl amide derivatives and uses thereof AR, NAT1, TBXA2R KMT2A 1756/4885MEN1 1261/4885MAPT 1160/4885

“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.