SCHEMBL10085581

SCHEMBL10085581

Cc1ccc2[nH]cc(C#N)c(=O)c2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.55
KDM4E B2RXH2 1/20 0.55
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
IMPDH2 P12268 1/20 0.46
IMPDH1 P20839 1/20 0.46
POLB P06746 2/20 0.45
NPC1 O15118 1/20 0.45
LMNA P02545 2/20 0.44
RAB9A P51151 1/20 0.44
NR4A2 P43354 1/20 0.44
HTR1D P28221 1/20 0.43
HTR2A P28223 1/20 0.43
IDO1 P14902 1/20 0.43
MCL1 Q07820 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
DUSP3 P51452 1/20 0.41
PTPN5 P54829 1/20 0.41
PTPN11 Q06124 1/20 0.41
ALDH1A1 P00352 2/20 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
SCHEMBL13202452 0.87 NR4A2 (0.44) HSD17B10KDM4EMEN1KMT2AIMPDH2
SCHEMBL6599646 0.86 IMPDH2 (0.56) HSD17B10KDM4EMEN1KMT2AIMPDH2
SCHEMBL5322018 0.81 IMPDH2 (0.46) HSD17B10KDM4EMEN1KMT2AIMPDH2
SCHEMBL3882080 0.81 IMPDH2 (0.46) IMPDH2IMPDH1IDO1SLC6A4
SCHEMBL5254495 0.81 CSNK2A1 (0.53) HSD17B10MEN1KMT2AIMPDH2IMPDH1
SCHEMBL14819972 0.80 HTR3E (0.45) HSD17B10KDM4EIMPDH2IMPDH1POLB
SCHEMBL5327318 0.80 ALDH1A1 (0.52) HSD17B10KDM4EMEN1KMT2ALMNA
SCHEMBL8344583 0.78 HSD17B10 (0.63) HSD17B10KDM4EMEN1KMT2APOLB
SCHEMBL5325067 0.77 HTR7 (0.49) HSD17B10KDM4EMEN1KMT2AIMPDH2
SCHEMBL5010332 0.76 IMPDH2 (0.72) KDM4EIMPDH2IMPDH1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2590975-B1 INDOLIZINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2015-08-19 EP disclosed
US-8859544-B2 Indolizine derivatives, process for the preparation thereof and therapeutic use thereof SANOFI (FR) 2014-10-14 US disclosed
US-8859544-B2 Indolizine derivatives, process for the preparation thereof and therapeutic use thereof SANOFI (FR) 2014-10-14 US disclosed
US-20130116249-A1 INDOLIZINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2013-05-09 US disclosed
US-20130116249-A1 INDOLIZINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2013-05-09 US disclosed
WO-2012004731-A1 INDOLIZINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-01-12 WO 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-20130116249-A1 INDOLIZINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND THERAPEUTIC USE THEREOF CCNY, INMT, IDO1 HSD17B10 4071/4885KDM4E 633/4885MEN1 1964/4885

“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.