SCHEMBL5195909

SCHEMBL5195909

CCOC(=O)CCN1Cc2ccccc2NCC1=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.42
ALOX15 P16050 2/20 0.41
NAMPT P43490 1/20 0.41
NOTUM Q6P988 1/20 0.41
TNF P01375 2/20 0.40
ITGB3 P05106 1/20 0.40
ITGA2B P08514 1/20 0.40
GAA P10253 1/20 0.39
BRPF1 P55201 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CREBBP Q92793 1/20 0.38
LMNA P02545 1/20 0.38
ALDH1A1 P00352 2/20 0.38
TSHR P16473 2/20 0.38
KDM4E B2RXH2 1/20 0.38
SIRT1 Q96EB6 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL5195087 0.93 TNF (0.47) BRD4ALOX15NAMPTNOTUMTNF
SCHEMBL5193879 0.86 NOTUM (0.43) ALOX15NOTUMITGB3ITGA2BGAA
SCHEMBL5194517 0.82 KDM4E (0.56) BRD4ALOX15ITGB3ITGA2BBRPF1
SCHEMBL5191281 0.81 BRPF1 (0.47) BRD4ALOX15ITGB3ITGA2BBRPF1
SCHEMBL5193610 0.78 BRPF1 (0.44) BRD4ALOX15ITGB3ITGA2BBRPF1
SCHEMBL14374090 0.78 KDM4E (0.41) BRD4ALOX15ITGB3ITGA2BBRPF1
SCHEMBL1759599 0.76 ALOX15 (0.49) BRD4ALOX15NOTUMGAAMEN1
SCHEMBL5194276 0.76 LMNA (0.46) BRD4ALOX15ITGB3ITGA2BBRPF1
SCHEMBL14374084 0.75 MAPK1 (0.50) ITGB3ITGA2BBRPF1ALDH1A1KDM4E
SCHEMBL5191836 0.74 ITGB3 (0.52) BRD4ALOX15ITGB3ITGA2BBRPF1

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-20070232594-A1 Aromatic amide derivatives, medicinal compositions containing the same, medical uses of both KISSEI PHARMACEUTICAL CO., LTD. (JP) 2007-10-04 US disclosed
US-20070232594-A1 Aromatic amide derivatives, medicinal compositions containing the same, medical uses of both KISSEI PHARMACEUTICAL CO., LTD. (JP) 2007-10-04 US disclosed
US-20070232594-A1 Aromatic amide derivatives, medicinal compositions containing the same, medical uses of both KISSEI PHARMACEUTICAL CO., LTD. (JP) 2007-10-04 US disclosed
EP-1813603-A1 AROMATIC AMIDE DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE SAME, MEDICAL USES OF BOTH Kissei Pharmaceutical Co., Ltd. (JP) 2007-08-01 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-20070232594-A1 Aromatic amide derivatives, medicinal compositions containing the same, medical uses of both AVPR2, AVPR1A, AVPR1B BRD4 1592/4885ALOX15 996/4885NAMPT 1315/4885

“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.