SCHEMBL4960902

SCHEMBL4960902

CCC(CC)(CC)N(C)C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL17635572 0.79
SCHEMBL20579051 0.79 CYP2D6 (0.30)
SCHEMBL898208 0.79 ALDH1A1 (0.33)
SCHEMBL28113803 0.79 ALDH1A1 (0.33)
SCHEMBL22047696 0.79
SCHEMBL22558358 0.73 ALDH1A1 (0.30)
SCHEMBL10628137 0.72 TSHR (0.31) TSHRTDP1
SCHEMBL31135990 0.71 ALDH1A1 (0.41) TSHR
SCHEMBL2332271 0.71 DNM1 (0.40) TSHR
SCHEMBL19522658 0.71 TSHR (0.33) TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6106994-A ESTERIFYING A POLYPHENOL COMPOUND AND NAPHTHOQUINONE-1,2-DIAZIDESULFONYL HALIDE IN THE PRESENCE OF FOR EXAMPLE MONOMETHYLDICYCLOHEXYLAMINE, AND POSITIVE PHOTOSENSITIVE COMPOSITION CONTAINS RESULTANT ESTER TOKYO OHKA KOGYO CO., LTD. (JP) 2000-08-22 US claimed
US-20170312363-A1 MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2017-11-02 US disclosed
US-9034315-B2 Cell-charged multi-layer collagen membrane ED. GEISTLICH SOEHNE AG FUER CHEMISCHE INDUSTRIE (CH) 2015-05-19 US disclosed
US-8858981-B2 Bone healing material comprising matrix carrying bone-forming cells Ed. Geistlich Soehne Fuer Chemistrie Industrie (CH) 2014-10-14 US disclosed
US-8354119-B2 Utilized as a scaffold implant for vertebral or meniscal cartilage regeneration. ED. GEISTLICH SOEHNE AG FUER CHEMISCHE INDUSTRIE (CH) 2013-01-15 US disclosed
EP-1938845-A2 Resorbable extracellular matrix for reconstruction of bone Ed Geistlich Söhne AG Für Chemische Industrie (CH) 2008-07-02 EP disclosed
US-7208177-B2 Resorbable extracellular matrix for reconstruction of cartilage ED. GEISTLICH SOEHNE AG FUER CHEMISCHE INDUSTRIE (CH) 2007-04-24 US disclosed
US-20070031388-A1 Cell-charged multi-layer collagen membrane ED. GEISTLICH SOEHNE AG FUER CHEMISCHE INDUSTRIE (CH) 2007-02-08 US disclosed
US-20060159668-A1 Bone healing mixture; collagen matrix and porous bone mineral material ED. GEISTLICH SOEHNE AG FUER CHEMISTRIE INDUSTRIE (CH) 2006-07-20 US disclosed
US-20030180263-A1 Resorbable extracellular matrix for reconstruction of bone ED. GEISTLICH SOEHNE AG FUER CHEMISCHE INDUSTRIE (CH) 2003-09-25 US disclosed
EP-1338291-A2 Resorbable extracellular matrix for reconstruction of bone ED. GEISTLICH SÖHNE AG FÜR CHEMISCHE INDUSTRIE (CH) 2003-08-27 EP disclosed
US-20030095994-A1 Resorbable extracellular matrix containing collagen I and collagen II for reconstruction of cartilage ED. GEISTLICH SOEHNE AG FUER CHEMISCHE INDUSTRIE (CH) 2003-05-22 US disclosed
EP-1312383-A2 Resorbable extracellular matrix containing collagen I and collagen II for reconstruction of cartilage Ed Geistlich Söhne AG Für Chemische Industrie (CH) 2003-05-21 EP disclosed
US-20020090391-A1 Resorbable extracellular matrix for reconstruction of cartilage CHEMISCHE INDUSTRIE (CH) 2002-07-11 US disclosed
EP-0352677-B1 Resin substrate for pigment pastes, its preparation and use HOECHST AG (DE) 1996-10-02 EP disclosed
US-5066758-A Cationic polymer for electrodeposition of paints HOECHST AG (DE) 1991-11-19 US disclosed
EP-0352677-A2 Resin substrate for pigment pastes, its preparation and use HOECHST AKTIENGESELLSCHAFT (DE) 1990-01-31 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 (3 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-20030180263-A1 Resorbable extracellular matrix for reconstruction of bone COL2A1, SOST, COL14A1 TSHR 4654/4885TDP1 4201/4885
US-20060159668-A1 Bone healing mixture; collagen matrix and porous bone mineral material COL2A1, BMP2, SOST TSHR 4796/4885TDP1 4530/4885
US-20170312363-A1 MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR HDGF, F11, F12 TSHR 1973/4885TDP1 4223/4885

“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.