Bromobenzene

Bromobenzene

SCHEMBL3345501

Brc1ccccc1.O=S(=O)(Cl)Cl.O=S(=O)(Cl)Cl

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.65
TDP1 Q9NUW8 2/20 0.65
HSD17B10 Q99714 1/20 0.50
MAPK1 P28482 1/20 0.46
IDO1 P14902 1/20 0.42
HTR6 P50406 1/20 0.41
CA2 P00918 3/20 0.40
CYP2A6 P11509 1/20 0.39
CA1 P00915 2/20 0.39
CA4 P22748 2/20 0.39
CA6 P23280 2/20 0.39
PLCG1 P19174 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
TSHR P16473 2/20 0.38
CA12 O43570 1/20 0.38
CA3 P07451 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
PLA2G7 Q13093 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
Bromobenzene SCHEMBL790814 1.00 ALDH1A1 (0.65) ALDH1A1TDP1HSD17B10MAPK1IDO1
Bromobenzene SCHEMBL28832826 0.97 ALDH1A1 (0.61) ALDH1A1TDP1HSD17B10MAPK1IDO1
Bromobenzene SCHEMBL9283182 0.89 ALDH1A1 (0.58) ALDH1A1TDP1HSD17B10MAPK1IDO1
Bromobenzene SCHEMBL9128632 0.89 ALDH1A1 (0.58) ALDH1A1TDP1HSD17B10MAPK1IDO1
Bromobenzene SCHEMBL11310655 0.89 ALDH1A1 (0.58) ALDH1A1TDP1HSD17B10MAPK1IDO1
Bromobenzene SCHEMBL29066414 0.89 ALDH1A1 (0.58) ALDH1A1TDP1HSD17B10MAPK1IDO1
Bromobenzene SCHEMBL27790136 0.86 ALDH1A1 (0.62) ALDH1A1TDP1HSD17B10MAPK1IDO1
Bromobenzene SCHEMBL27600902 0.86 TDP1 (0.48) ALDH1A1TDP1HSD17B10MAPK1IDO1
Bromobenzene SCHEMBL27406963 0.85 ALDH1A1 (0.69) ALDH1A1TDP1HSD17B10MAPK1IDO1
Bromobenzene SCHEMBL28433062 0.85 ALDH1A1 (0.52) ALDH1A1TDP1HSD17B10MAPK1IDO1

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-7723332-B2 Aryl sulfonamides useful for modulation of the progesterone receptor WYETH LLC (US) 2010-05-25 US disclosed
EP-2137145-A2 CYANOPYRROL SULFONAMIDES USEFUL FOR MODULATION OF THE PROGESTERONE RECEPTOR Wyeth (US) 2009-12-30 EP disclosed
WO-2008109055-A2 CYANOPYRROLE SULFONAMIDES USEFUL FOR MODULATION OF THE PROGESTERONE RECEPTOR WYETH (US) 2008-09-12 WO disclosed
US-20080221201-A1 4-(5-cyano-1-methyl-1H-pyrrol-2-yl)-N-methylbenzenesulfonamide; contraception, treating or preventing fibroids, uterine leiomyomata, endometriosis, dysfunctional bleeding, polycystic ovary syndrome, or hormone-dependent carcinomas, providing hormone replacement therapy, stimulating food intake WYETH (US) 2008-09-11 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-20080221201-A1 4-(5-cyano-1-methyl-1H-pyrrol-2-yl)-N-methylbenzenesulfonamide; contraception, treating or preventing fibroids, uterine leiomyomata, endometriosis, dysfunctional bleeding, polycystic ovary syndrome, or hormone-dependent carcinomas, providing hormone replacement therapy, stimulating food intake PKD1, PKD2, SHBG ALDH1A1 1586/4885TDP1 4486/4885HSD17B10 1618/4885

“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.