SCHEMBL201980

SCHEMBL201980

C=C(C)C(=O)Nc1ccc(C#N)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.57
MAPT P10636 3/20 0.53
LMNA P02545 3/20 0.53
TSHR P16473 1/20 0.53
HTT P42858 1/20 0.53
NLRP3 Q96P20 1/20 0.53
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
KDM4E B2RXH2 2/20 0.51
RAB9A P51151 2/20 0.51
SAE1 Q9UBE0 1/20 0.51
UBA2 Q9UBT2 1/20 0.51
POLB P06746 1/20 0.51
PKM P14618 1/20 0.51
MAPK1 P28482 1/20 0.51
IL18 Q14116 1/20 0.51
KDM1A O60341 1/20 0.51
IDO1 P14902 2/20 0.50
ALDH1A1 P00352 3/20 0.49
TAS1R3 Q7RTX0 1/20 0.47

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
SCHEMBL14394818 0.86 KDM1A (0.76) MEN1KMT2AKDM4EMAPK1KDM1A
SCHEMBL439393 0.84 RXFP1 (0.74) RXFP1MAPTTSHRHTTMEN1
SCHEMBL9397486 0.83 DHODH (0.52) RXFP1MAPTLMNATSHRHTT
SCHEMBL9397490 0.83 DHODH (0.52) RXFP1MAPTLMNATSHRHTT
SCHEMBL10957092 0.83 CXCR2 (0.60) RXFP1MAPTLMNATSHRHTT
SCHEMBL31598551 0.82 MAPT (0.53) MAPTLMNATSHRHTTNLRP3
SCHEMBL17792928 0.82 RXFP1 (0.57) RXFP1MEN1KMT2AKDM4ERAB9A
SCHEMBL1344408 0.81 KDM1A (0.71) MAPTLMNATSHRHTTNLRP3
SCHEMBL708851 0.81 CA12 (0.46) RXFP1MAPTLMNAMEN1KMT2A
SCHEMBL6667746 0.80 TDP1 (0.62) MAPTLMNATSHRHTTMEN1

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190176459-A1 POSITIVE TYPE PLANOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD OF PRODUCING PLANOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2019-06-13 US disclosed
US-9822206-B2 Copolymers for near-infrared radiation-sensitive coating compositions for positive-working thermal lithographic printing plates MYLAN GROUP (VN) 2017-11-21 US disclosed
US-9822206-B2 Copolymers for near-infrared radiation-sensitive coating compositions for positive-working thermal lithographic printing plates MYLAN GROUP (VN) 2017-11-21 US disclosed
US-9822206-B2 Copolymers for near-infrared radiation-sensitive coating compositions for positive-working thermal lithographic printing plates MYLAN GROUP (VN) 2017-11-21 US disclosed
CN-104803916-B Hete rocyclic derivatives as SARM (SARMS) 詹森药业有限公司 2017-08-11 CN disclosed
EP-2566900-B1 COPOLYMERS FOR NEAR-INFRARED RADIATION-SENSITIVE COATING COMPOSITIONS FOR POSITIVE-WORKING THERMAL LITHOGRAPHIC PRINTING PLATES MYLAN GROUP (VN) 2016-02-17 EP disclosed
EP-2566900-B1 COPOLYMERS FOR NEAR-INFRARED RADIATION-SENSITIVE COATING COMPOSITIONS FOR POSITIVE-WORKING THERMAL LITHOGRAPHIC PRINTING PLATES MYLAN GROUP (VN) 2016-02-17 EP disclosed
CN-104803916-A Novel heterocycle derivatives useful as selective androgen receptor modulators (sarms) JANSSEN PHARMACEUTICA NV 2015-07-29 CN disclosed
EP-1817292-B1 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA NV (BE) 2015-04-08 EP disclosed
EP-1817292-B1 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA NV (BE) 2015-04-08 EP disclosed
US-20090131365-A1 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) ZHANG XUQING 2009-05-21 US disclosed
US-7465809-B2 Heterocycle derivatives useful as selective androgen receptor modulators (SARMs) JANSSEN PHARMACEUTICA N.V. (BG) 2008-12-16 US disclosed
US-7465809-B2 Heterocycle derivatives useful as selective androgen receptor modulators (SARMs) JANSSEN PHARMACEUTICA N.V. (BG) 2008-12-16 US disclosed
US-20080044763-A1 Resin composition and thermo/photosensitive composition FUJIFILM CORPORATION 2008-02-21 US disclosed
US-20080044763-A1 Resin composition and thermo/photosensitive composition FUJIFILM CORPORATION 2008-02-21 US disclosed
EP-1817292-A2 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA N.V. (BE) 2007-08-15 EP disclosed
CN-1278853-C Image recording material FUJI PHOTO FILM CO LTD (JP) 2006-10-11 CN disclosed
US-20060211756-A1 Novel heterocycle derivatives useful as selective androgen receptor modulators (SARMs) JANSSEN PHARMACEUTICA N.V. (BE) 2006-09-21 US disclosed
WO-2006055184-A2 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) JANSSEN PHARMACEUTICA N.V. (BE) 2006-05-26 WO disclosed
CN-1406747-A Image recording material FUJI PHOTO FILM CO LTD (JP) 2003-04-02 CN 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-20060211756-A1 Novel heterocycle derivatives useful as selective androgen receptor modulators (SARMs) AR, NR5A1, NR5A2 RXFP1 812/4885MAPT 2544/4885LMNA 3680/4885
US-20090131365-A1 NOVEL HETEROCYCLE DERIVATIVES USEFUL AS SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) AR, NR5A1, NR5A2 RXFP1 812/4885MAPT 2544/4885LMNA 3680/4885

“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.