SCHEMBL1196191

SCHEMBL1196191

C=C(C)C(=O)NOCCCC.C=CC(=O)N(C)C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.39
HPGD P15428 1/20 0.39
ZDHHC20 Q5W0Z9 3/20 0.33
ALDH1A1 P00352 1/20 0.33
ZDHHC2 Q9UIJ5 2/20 0.32
ATM Q13315 1/20 0.31
CNR2 P34972 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL194349 0.84 TSHR (0.44) TSHRHPGDALDH1A1ATMCNR2
SCHEMBL9136822 0.82 TSHR (0.38) TSHRHPGDZDHHC20ALDH1A1ZDHHC2
SCHEMBL28188097 0.80 TDP1 (0.43) TSHRHPGDALDH1A1ATMCNR2
SCHEMBL5682722 0.80 TSHR (0.52) TSHRALDH1A1CNR2TRPV1
Acrylonitrile SCHEMBL28077128 0.79 TSHR (0.38) TSHRHPGDZDHHC20ALDH1A1ZDHHC2
SCHEMBL1123372 0.78 TSHR (0.55) TSHRCNR2TRPV1
SCHEMBL2001226 0.78 TSHR (0.55) TSHRCNR2TRPV1
SCHEMBL9450143 0.78 TSHR (0.55) TSHRCNR2TRPV1
SCHEMBL28923222 0.78 TSHR (0.55) TSHRCNR2TRPV1
SCHEMBL20657393 0.75 ZDHHC20 (0.53) ZDHHC20ZDHHC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2467755-B1 METHOD FOR A SUB MICROSCOPIC AND OPTICALLY VARIABLE IMAGE CARRYING DEVICE BASF SE (DE) 2016-10-12 EP disclosed
US-9310676-B2 Apparatus and method for a sub microscopic and optically variable image carrying device BASF SE (DE) 2016-04-12 US disclosed
US-9199934-B2 Alpha-hydroxyketones BASF SE (DE) 2015-12-01 US disclosed
EP-2129659-B1 ALPHA-HYDROXYKETONES BASF SE (DE) 2013-05-29 EP disclosed
US-20120199994-A1 APPARATUS AND METHOD FOR A SUB MICROSCOPIC AND OPTICALLY VARIABLE IMAGE CARRYING DEVICE BASF SE (DE) 2012-08-09 US disclosed
EP-2084005-B1 APPARATUS AND METHOD FOR MANUFACTURING A SECURITY PRODUCT BASF SE (DE) 2012-06-13 EP disclosed
US-20110033664-A1 METHOD FOR PRODUCING AN OPTICALLY VARIABLE IMAGE CARRYING SHIM BASF SE (DE) 2011-02-10 US disclosed
EP-2212113-A1 A METHOD FOR PRODUCING AN OPTICALLY VARIABLE IMAGE CARRYING SHIM BASF SE (DE) 2010-08-04 EP disclosed
US-20100104979-A1 ALPHA-HYDROXYKETONES IGM GROUP B.V. (NL) 2010-04-29 US disclosed
US-20100090455-A1 APPARATUS AND METHOD FOR MANUFACTURING A SECURITY PRODUCT CIBA CORPORATION (US) 2010-04-15 US disclosed
US-7648738-B2 for photopolymerization; photography, relief imaging; color filters CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-01-19 US disclosed
WO-2009062867-A1 A METHOD FOR PRODUCING AN OPTICALLY VARIABLE IMAGE CARRYING SHIM BASF SE (CH) 2009-05-22 WO disclosed
EP-1567518-B1 OXIME ESTER PHOTOINITIATORS WITH HETEROAROMATIC GROUPS CIBA HOLDING INC (CH) 2009-01-14 EP disclosed
US-20060241259-A1 Oxime ester photoinitiators with heteroaromatic groups CIBA CORPORATION 2006-10-26 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-20100104979-A1 ALPHA-HYDROXYKETONES C9, C1R, CBR3 TSHR 1494/4885HPGD 783/4885ZDHHC20 866/4885

“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.