SCHEMBL7931995

SCHEMBL7931995

CCCCCCCCCC[S+]([O-])CC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
THRB P10828 1/20 0.44
DNM1 Q05193 7/20 0.38
CES2 O00748 3/20 0.36
CES1 P23141 3/20 0.36
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HSD17B10 Q99714 1/20 0.35
SLC22A1 O15245 1/20 0.35

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
SCHEMBL10866350 1.00 TSHR (0.44) TSHRTHRBDNM1CES2CES1
SCHEMBL902302 1.00 TSHR (0.44) TSHRTHRBDNM1CES2CES1
SCHEMBL11192942 1.00 TSHR (0.44) TSHRTHRBDNM1CES2CES1
SCHEMBL6662074 1.00 TSHR (0.44) TSHRTHRBDNM1CES2CES1
SCHEMBL11880617 1.00 TSHR (0.44) TSHRTHRBDNM1CES2CES1
SCHEMBL25599070 1.00 TSHR (0.44) TSHRTHRBDNM1CES2CES1
SCHEMBL30846998 1.00 TSHR (0.44) TSHRTHRBDNM1CES2CES1
SCHEMBL5424877 1.00 TSHR (0.44) TSHRTHRBDNM1CES2CES1
SCHEMBL3371704 0.97
SCHEMBL17817329 0.95 TSHR (0.40) TSHRTHRBDNM1CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0612525-B1 Transdermal treatment with mast cell degranulating agents for drug-induced hypersensitivity BRISTOL MYERS SQUIBB CO (US) 2001-09-19 EP claimed
EP-0612525-A1 Transdermal treatment with mast cell degranulating agents for drug-induced hypersensitivity BRISTOL-MYERS SQUIBB COMPANY (US) 1994-08-31 EP claimed
CN-117396223-A Methods of treating nonalcoholic steatohepatitis using SCD-1 inhibitors 利皮迪奥制药公司 2024-01-12 CN disclosed
WO-2014123977-A1 GERANYLGERANYLACETONE FORMULATIONS ROHTO USA, INC. (US) 2014-08-14 WO disclosed
US-20130273138-A1 TRANSDERMAL FORMULATIONS OF GERANYLGERANYLACETONE COYOTE PHARMACEUTICALS, INC. 2013-10-17 US disclosed
WO-2013130648-A1 TRANSDERMAL FORMULATIONS OF GERANYLGERANYLACETONE COYOTE PHARMACEUTICALS, INC. (US) 2013-09-06 WO disclosed
EP-0754006-A4 METHOD AND APPARATUS FOR DIAGNOSING ERECTILE DYSFUNCTION VIVUS INC (US) 1998-08-19 EP disclosed
EP-0841896-A1 REVERSE GELS COMPRISING A CONTINUOUS FLUORINATED PHASE ALLIANCE PHARMACEUTICAL CORPORATION (US) 1998-05-20 EP disclosed
WO-1997003644-A1 REVERSE GELS COMPRISING A CONTINUOUS FLUORINATED PHASE ALLIANCE PHARMACEUTICAL CORP. (US) 1997-02-06 WO disclosed
EP-0754006-A1 METHOD AND APPARATUS FOR DIAGNOSING ERECTILE DYSFUNCTION Vivus, Inc. (US) 1997-01-22 EP disclosed
WO-1995026158-A1 METHOD AND APPARATUS FOR DIAGNOSING ERECTILE DYSFUNCTION VIVUS, INC. (US) 1995-10-05 WO disclosed
EP-0591432-A4 SOLUBILITY PARAMETER BASED DRUG DELIVERY SYSTEM AND METHOD FOR ALTERING DRUG SATURATION CONCENTRATION. NOVEN PHARMA (US) 1995-05-17 EP disclosed
EP-0379045-B1 Transdermal acrylic multipolymer drug delivery system NOVEN PHARMA (US) 1995-05-10 EP disclosed
EP-0591432-A1 SOLUBILITY PARAMETER BASED DRUG DELIVERY SYSTEM AND METHOD FOR ALTERING DRUG SATURATION CONCENTRATION NOVEN PHARMACEUTICALS, INC. (US) 1994-04-13 EP disclosed
US-4086079-A FOR FRUIT BEARING PLANTS THE PROCTER & GAMBLE COMPANY (US) 1978-04-25 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-20130273138-A1 TRANSDERMAL FORMULATIONS OF GERANYLGERANYLACETONE GAP43, GGPS1, FNTA TSHR 3280/4885THRB 1033/4885DNM1 2908/4885

“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.