SCHEMBL7918841

SCHEMBL7918841

O=C(O)C1CCCN1c1ccncc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
PORCN Q9H237 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 2/20 0.43
HSD17B10 Q99714 1/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 3/20 0.41
RECQL P46063 1/20 0.41
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
CHKA P35790 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA7 P36544 1/20 0.40
CHRNA4 P43681 1/20 0.40
BRS3 P32247 1/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL6703929 1.00 SMN1; SMN2 (0.50) SMN1; SMN2PORCNKMT2AMAPTHSD17B10
SCHEMBL6173007 0.95 SMN1; SMN2 (0.46) SMN1; SMN2PORCNKMT2AMAPTHSD17B10
SCHEMBL630857 0.84 SMN1; SMN2 (0.51) SMN1; SMN2PORCNKMT2AMAPTHSD17B10
SCHEMBL432319 0.84 SMN1; SMN2 (0.51) SMN1; SMN2PORCNKMT2AMAPTHSD17B10
SCHEMBL15664724 0.84 SMN1; SMN2 (0.51) SMN1; SMN2PORCNKMT2AMAPTHSD17B10
Hydrochloric Acid SCHEMBL28132801 0.83 SMN1; SMN2 (0.50) SMN1; SMN2PORCNKMT2AMAPTHSD17B10
SCHEMBL15665079 0.81 SMN1; SMN2 (0.52) SMN1; SMN2PORCNKMT2AMAPTHSD17B10
SCHEMBL15665299 0.81 SMN1; SMN2 (0.52) SMN1; SMN2PORCNKMT2AMAPTHSD17B10
SCHEMBL29507440 0.81 SMN1; SMN2 (0.52) SMN1; SMN2PORCNKMT2AMAPTHSD17B10
SCHEMBL25262222 0.81 TDP1 (0.45) SMN1; SMN2PORCNKMT2AMAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111278840-B Pyrrolo [2,3-B ] pyridine compounds and their use for the treatment of cancer 癌症研究科技有限公司 2023-11-17 CN disclosed
US-6242262-B1 MIXING DISCRETE SOLID SUPPORTS, EACH HAVING DIFFERENT ORGANIC COMPOUND, WITH REACTION SOLUTION SO THAT SUPPORTS ARE AT AN INTERFACE IN VESSEL; THEN DETECTING TEMPERATURE CHANGE OF A SOLID SUPPORT AS INDICATION OF AN ACTIVE CATALYST THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2001-06-05 US disclosed
WO-1999021957-A9 METHOD AND APPARATUS FOR SCREENING CATALYST LIBRARIES UNIV NORTH CAROLINA (US) 1999-08-12 WO disclosed
WO-1999021957-A1 METHOD AND APPARATUS FOR SCREENING CATALYST LIBRARIES THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1999-05-06 WO disclosed
EP-0538931-A2 Curing catalyst for the reaction between carboxyl functional polymers and epoxy functional compounds for use in the preparation of powder coatings DSM N.V. (NL) 1993-04-28 EP disclosed