SCHEMBL2700947

SCHEMBL2700947

CC(=O)Oc1ccccc1C(=O)Nc1ccc(Br)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.62
NPC1 O15118 2/20 0.62
KMT2A Q03164 5/20 0.59
MAPT P10636 4/20 0.59
USP2 O75604 1/20 0.59
LMNA P02545 1/20 0.56
ALDH1A1 P00352 3/20 0.56
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
KDM4E B2RXH2 2/20 0.54
HPGD P15428 2/20 0.54
HSD17B10 Q99714 2/20 0.54
ESR1 P03372 1/20 0.54
ITGB3 P05106 1/20 0.54
ITGA2B P08514 1/20 0.54
HMGB1 P09429 1/20 0.54
TSHR P16473 1/20 0.54
GGT1 P19440 1/20 0.54

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
SCHEMBL10192623 0.89 KMT2A (0.68) RAB9AKMT2AMAPTUSP2LMNA
SCHEMBL2703394 0.88 LMNA (0.62) RAB9ANPC1KMT2AMAPTUSP2
SCHEMBL6819232 0.87 CA1 (0.57) RAB9ANPC1KMT2AMAPTUSP2
SCHEMBL2699617 0.87 POLB (0.55) RAB9AKMT2AMAPTUSP2ALDH1A1
SCHEMBL2700957 0.87 KMT2A (0.55) RAB9ANPC1KMT2AMAPTUSP2
SCHEMBL4432153 0.86 MAPT (0.69) RAB9ANPC1KMT2AMAPTLMNA
SCHEMBL4328090 0.86 CA1 (0.59) RAB9ANPC1KMT2AMAPTUSP2
SCHEMBL27901571 0.85 KMT2A (0.71) RAB9ANPC1KMT2AMAPTLMNA
SCHEMBL2703311 0.84 P2RX1 (0.63) RAB9ANPC1KMT2AMAPTUSP2
SCHEMBL16190177 0.84 CA1 (0.60) RAB9ANPC1KMT2AMAPTUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102827021-A 2-acetoxyl-N-(4-bromophenyl) benzamide, as well as preparation method and application thereof UNIV XIHUA 2012-12-19 CN disclosed
CN-102827021-A 2-acetoxyl-N-(4-bromophenyl) benzamide, as well as preparation method and application thereof UNIV XIHUA 2012-12-19 CN disclosed
WO-2012058378-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF SALICYLANILIDES FOR TREATMENT OF HEPATITIS VIRUSES ROMARK LABORATORIES L.C. (US) 2012-05-03 WO disclosed
WO-2012058378-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF SALICYLANILIDES FOR TREATMENT OF HEPATITIS VIRUSES ROMARK LABORATORIES L.C. (US) 2012-05-03 WO disclosed
US-20120108592-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF SALICYLANILIDES FOR TREATMENT OF HEPATITIS VIRUSES ROMARK LABORATORIES, L.C. 2012-05-03 US disclosed
US-20120108592-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF SALICYLANILIDES FOR TREATMENT OF HEPATITIS VIRUSES ROMARK LABORATORIES, L.C. 2012-05-03 US disclosed
US-20120108592-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF SALICYLANILIDES FOR TREATMENT OF HEPATITIS VIRUSES ROMARK LABORATORIES, L.C. 2012-05-03 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-20120108592-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF SALICYLANILIDES FOR TREATMENT OF HEPATITIS VIRUSES PYGL, GYS2, GLS2 RAB9A 4295/4885NPC1 2616/4885KMT2A 3654/4885

“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.