SCHEMBL7700420

SCHEMBL7700420

C=C(C(=O)OCCN)C(CCCCC)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
CNR1 P21554 1/20 0.36
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
CPB2 Q96IY4 1/20 0.33
ZDHHC7 Q9NXF8 1/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HSPD1 P10809 1/20 0.33
BLM P54132 1/20 0.33
HSPE1 P61604 1/20 0.33
GRIK1 P39086 2/20 0.33
GRIK2 Q13002 2/20 0.33
SLC1A2 P43004 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
SCHEMBL4917892 0.83 THRB (0.33) TSHRTHRBCA2CA1
SCHEMBL4596306 0.80 CA2 (0.43) TSHRALDH1A1MAPTTHRBCNR1
SCHEMBL7757309 0.78 THRB (0.32) TSHRTHRBCPB2
SCHEMBL4916463 0.78 CA2 (0.49) TSHRALDH1A1MAPTTHRBCNR1
SCHEMBL4919357 0.78 CA2 (0.41) TSHRALDH1A1MAPTTHRBCNR1
SCHEMBL4596321 0.73 HDAC1 (0.38) TSHRALDH1A1MAPTTHRBCNR1
SCHEMBL5268023 0.73 HSPD1 (0.45) MAPTMEN1HPGDRECQLKMT2A
SCHEMBL4915775 0.73 TSHR (0.34) TSHRALDH1A1MAPTTHRBCNR1
SCHEMBL17848563 0.72 TSHR (0.61) TSHRALDH1A1LMNAZDHHC7GRIK1
SCHEMBL689149 0.72 TSHR (0.61) TSHRALDH1A1LMNAZDHHC7GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4077932-A VINYL NITROGEN MONOMER, EPOXY SILANE BORDEN, INC. (US) 1978-03-07 US claimed
US-6348636-B1 REMOVING VOLATILE ORGANIC CONTAMINANTS FROM AQUEOUS POLYMER DISPERSION BY CONTACTING WITH STRIPPING AGENT SELECTED FROM STEAM, GAS AND VAPOR IN PRESENCE OF SOLID ADSORBENT BASF CORPORATION 2002-02-19 US disclosed
EP-0010000-B1 MASTIC, CAULKING, SEALANT AND ADHESIVE COMPOSITIONS CONTAINING PHOTOSENSITIVE COMPOUNDS AND METHOD OF REDUCING THEIR SURFACE TACK ROHM AND HAAS COMPANY (US) 1983-06-22 EP disclosed
US-4292220-A CAULKING ROHM AND HAAS COMPANY (US) 1981-09-29 US disclosed
EP-0010000-A1 Mastic, caulking, sealant and adhesive compositions containing photosensitive compounds and method of reducing their surface tack ROHM AND HAAS COMPANY (US) 1980-04-16 EP disclosed
US-4160750-A Aqueous acrylic contact cement BORDEN, INC. (US) 1979-07-10 US disclosed
US-4077932-A VINYL NITROGEN MONOMER, EPOXY SILANE BORDEN, INC. (US) 1978-03-07 US disclosed
US-4032487-A AQUEOUS ACRYLATE-EPOXY SILANE CROSSLINKER ADHESIVE DISPERSION COMPOSITION BORDEN, INC. (US) 1977-06-28 US disclosed
US-4023977-A POLYMETHYL METHACRYLATE, CELLULOSE ACETATE BUTYRATE, CELLULOSE NITRATE ROHM AND HAAS COMPANY (US) 1977-05-17 US disclosed
US-3969560-A Copolymers of monounsaturated or diunsaturated polyesters with vinyl monomers ROHM AND HAAS COMPANY (US) 1976-07-13 US disclosed
US-3944513-A Purification of polymer dispersions with adsorbent carbon particles ROHM AND HAAS COMPANY (US) 1976-03-16 US disclosed