Resatorvid

Resatorvid

SCHEMBL1821271

CCOC(=O)C1=CCCC[C@@H]1S(=O)(=O)Nc1ccc(F)cc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

TLR4

The experimentally established mechanism targets of Resatorvid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TLR4 known ✓ O00206 9/20 1.00
MRGPRX1 Q96LB2 6/20 0.43
TSPO P30536 2/20 0.41
HRH1 P35367 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.39

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
Resatorvid SCHEMBL29607069 1.00 TLR4 (1.00) TLR4MRGPRX1TSPOHRH1KMT2A
Resatorvid SCHEMBL871572 1.00 TLR4 (1.00) TLR4MRGPRX1TSPOHRH1KMT2A
Resatorvid SCHEMBL872197 1.00 TLR4 (1.00) TLR4MRGPRX1TSPOHRH1KMT2A
Resatorvid SCHEMBL30113148 1.00 TLR4 (1.00) TLR4MRGPRX1TSPOHRH1KMT2A
SCHEMBL871253 0.97 TLR4 (1.00) TLR4MRGPRX1TSPOHRH1KMT2A
SCHEMBL871685 0.94 TLR4 (1.00) TLR4MRGPRX1TSPOHRH1KMT2A
Resatorvid SCHEMBL13944442 0.90 TLR4 (0.82) TLR4MRGPRX1TSPOHRH1KMT2A
Resatorvid SCHEMBL13944682 0.90 TLR4 (0.82) TLR4MRGPRX1TSPOHRH1KMT2A
Resatorvid SCHEMBL13944518 0.90 TLR4 (0.82) TLR4MRGPRX1TSPOHRH1KMT2A
Resatorvid SCHEMBL13944446 0.90 TLR4 (0.85) TLR4MRGPRX1TSPOHRH1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2528598-A1 COMPOUNDS FOR SUPPRESSING A PERIPHERAL NERVE DISORDER INDUCED BY AN ANTI - CANCER AGENT Takeda Pharmaceutical Company Limited (JP) 2012-12-05 EP disclosed
WO-2011093512-A1 COMPOUNDS FOR SUPPRESSING A PERIPHERAL NERVE DISORDER INDUCED BY AN ANTI - CANCER AGENT TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-08-04 WO disclosed
EP-1334966-B1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE SULFONAMIDES AND INTERMEDIATES FOR THEIR SYNTHESIS TAKEDA PHARMACEUTICAL (JP) 2011-05-04 EP disclosed
WO-2009015028-A1 SUBSTITUTED CYCLOHEXENES AUSPEX PHARMACEUTICALS, INC. (US) 2009-01-29 WO disclosed
US-20090022706-A1 SUBSTITUTED CYCLOHEXENES AUSPEX PHARMACEUTICALS, INC. (US) 2009-01-22 US disclosed
US-20090022706-A1 SUBSTITUTED CYCLOHEXENES AUSPEX PHARMACEUTICALS, INC. (US) 2009-01-22 US disclosed
US-6982344-B2 Process for preparation of optically active sulfonamides and intermediates for their synthesis TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-03 US disclosed
US-20040049041-A1 Process for preparation of optically active sulfonamides and intermediates for their synthesis TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-03-11 US disclosed
EP-1334966-A1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE SULFONAMIDES AND INTERMEDIATES FOR THEIR SYNTHESIS Takeda Chemical Industries, Ltd. (JP) 2003-08-13 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 (2 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-20040049041-A1 Process for preparation of optically active sulfonamides and intermediates for their synthesis STS, ARSA, SULT1A1 TLR4 4118/4885MRGPRX1 2708/4885TSPO 4365/4885
US-20090022706-A1 SUBSTITUTED CYCLOHEXENES TLR4, TLR2, TLR1 TLR4 1/4885MRGPRX1 306/4885TSPO 1310/4885

“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.