SCHEMBL4276293

SCHEMBL4276293

CC(C)NC(=O)c1cc(Oc2ccccc2)ccc1NC(=O)c1ccc(NS(C)(=O)=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.55
MAPK10 P53779 1/20 0.55
PGR P06401 3/20 0.53
ALDH1A1 P00352 4/20 0.52
MAPK1 P28482 1/20 0.52
F10 P00742 1/20 0.51
SERPINE1 P05121 1/20 0.50
MAPT P10636 1/20 0.48
NR1H4 Q96RI1 1/20 0.47
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
HDAC3 O15379 1/20 0.45
BRAF P15056 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45

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
SCHEMBL13748324 0.87 SERPINE1 (0.57) PGRALDH1A1SERPINE1NR1H4KDM4E
SCHEMBL4269233 0.86 SERPINE1 (0.60) ALDH1A1SERPINE1MAPTNR1H4KDM4E
SCHEMBL4281119 0.86 SERPINE1 (0.57) PGRALDH1A1SERPINE1MAPTNR1H4
SCHEMBL4284613 0.84 SERPINE1 (0.55) PGRALDH1A1SERPINE1MAPTNR1H4
SCHEMBL4271457 0.84 SERPINE1 (0.55) PGRALDH1A1SERPINE1NR1H4KDM4E
SCHEMBL4276696 0.80 NR1H4 (0.53) ALDH1A1SERPINE1NR1H4LMNAMEN1
SCHEMBL4273626 0.79 SERPINE1 (0.49) ALDH1A1SERPINE1MAPTNR1H4LMNA
SCHEMBL4284605 0.78 SERPINE1 (0.54) ALDH1A1SERPINE1HDAC1HDAC8HDAC6
SCHEMBL4278030 0.78 STK39 (0.57) HPGDALDH1A1SERPINE1KDM4ELMNA
SCHEMBL4268642 0.78 SERPINE1 (0.58) ALDH1A1F10SERPINE1LMNAHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060135619-A1 2-[(3-chloro-4-hydroxybenzoyl)amino]-N-[2-(2-methoxyphenyl)ethyl]-5-phenoxybenzamide; therapeutic use as anti-cancer agents, as well as other therapeutic agents, for example, as anti-fertility agents BRISTOL-MYERS SQUIBB COMPANY 2006-06-22 US claimed
US-7569725-B2 2-[(3-chloro-4-hydroxybenzoyl)amino]-N-[2-(2-methoxyphenyl)ethyl]-5-phenoxybenzamide; therapeutic use as anti-cancer agents, as well as other therapeutic agents, for example, as anti-fertility agents BRITSOL-MYERS SQUIBB COMPANY (US) 2009-08-04 US disclosed
US-20060135619-A1 2-[(3-chloro-4-hydroxybenzoyl)amino]-N-[2-(2-methoxyphenyl)ethyl]-5-phenoxybenzamide; therapeutic use as anti-cancer agents, as well as other therapeutic agents, for example, as anti-fertility agents BRISTOL-MYERS SQUIBB COMPANY 2006-06-22 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-20060135619-A1 2-[(3-chloro-4-hydroxybenzoyl)amino]-N-[2-(2-methoxyphenyl)ethyl]-5-phenoxybenzamide; therapeutic use as anti-cancer agents, as well as other therapeutic agents, for example, as anti-fertility agents NASP, BRDT, ACR HPGD 604/4885MAPK10 2201/4885PGR 158/4885

“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.