SCHEMBL2500149

SCHEMBL2500149

CN1CCN(CCN(Cc2ccc(C(=O)Nc3ccccc3NC(=O)OC(C)(C)C)cc2)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.45
WDR5 P61964 5/20 0.44
ABL1 P00519 1/20 0.41
BCR P11274 1/20 0.41
KDM1A O60341 1/20 0.40
MCHR1 Q99705 3/20 0.40
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
GAA P10253 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPK1 P28482 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
BRAF P15056 1/20 0.37
CASR P41180 1/20 0.37

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
SCHEMBL2478564 0.91 MCHR1 (0.43) EGFRKDM1AMCHR1ALDH1A1MAPT
SCHEMBL2477767 0.89 ALDH1A1 (0.43) EGFRWDR5KDM1AMCHR1ALDH1A1
SCHEMBL2480501 0.89 MAPT (0.46) EGFRWDR5KDM1AMCHR1ALDH1A1
SCHEMBL2480569 0.89 EGFR (0.47) EGFRWDR5ABL1BCRMCHR1
SCHEMBL3830942 0.87 KDM1A (0.45) KDM1AMCHR1MAPTLMNABRAF
SCHEMBL3832833 0.87 HDAC1 (0.46) ALDH1A1MAPTGAASMN1; SMN2LMNA
SCHEMBL3835064 0.86 KDM1A (0.45) EGFRKDM1AMCHR1ALDH1A1MAPT
SCHEMBL2476793 0.84 ALDH1A1 (0.49) KDM1AALDH1A1MAPTGAAMAPK1
SCHEMBL3832544 0.83 TNF (0.46) KDM1AALDH1A1MAPTGAA
SCHEMBL3835504 0.83 TP53 (0.45) ALDH1A1MAPTGAASMN1; SMN2MAPK1

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
US-8076332-B2 N- (2-aminophenyl) benzamide derivative having urea structure SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-12-13 US disclosed
EP-2107052-B1 NOVEL N-(2-AMINOPHENYL)BENZAMIDE DERIVATIVE HAVING AN UREA STRUCTURE SANTEN PHARMACEUTICAL CO LTD (JP) 2011-10-12 EP disclosed
US-20090306077-A1 NOVEL N- (2-AMINOPHENYL) BENZAMIDE DERIVATIVE HAVING UREA STRUCTURE SANTEN PHARMACEUTICAL CO., LTD. (JP) 2009-12-10 US disclosed
EP-2107052-A1 NOVEL N-(2-AMINOPHENYL)BENZAMIDE DERIVATIVE HAVING AN UREA STRUCTURE Santen Pharmaceutical Co., Ltd (JP) 2009-10-07 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-20090306077-A1 NOVEL N- (2-AMINOPHENYL) BENZAMIDE DERIVATIVE HAVING UREA STRUCTURE UACA, SLC14A1, ARG2 EGFR 2604/4885WDR5 3290/4885ABL1 3053/4885

“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.