SCHEMBL901023

SCHEMBL901023

Cc1nc2c(-c3cccc(-c4ccccc4)c3C(F)(F)F)cccc2s1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 4/20 0.41
ALOX5 P09917 1/20 0.35
RET P07949 1/20 0.34
FLT1 P17948 1/20 0.34
KDR P35968 1/20 0.34
MAPK14 Q16539 1/20 0.34
TSHR P16473 1/20 0.34
HSD11B1 P28845 2/20 0.33
MAPT P10636 2/20 0.33
LIMK1 P53667 1/20 0.33
SCN9A Q15858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
S1PR1 P21453 1/20 0.32
GRM5 P41594 1/20 0.32

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
SCHEMBL900791 0.84 ALOX5 (0.43) ENPP1ALOX5RETFLT1KDR
SCHEMBL900782 0.80 HSD11B1 (0.44) TSHRHSD11B1HSD17B10
SCHEMBL901020 0.79 PDCD1 (0.43) ENPP1RETFLT1KDRMAPK14
SCHEMBL4846110 0.79 ENPP1 (0.44) ENPP1
SCHEMBL22891113 0.76 ALDH1A1 (0.43) HSD11B1MAPTHSD17B10
SCHEMBL19629705 0.74 L3MBTL1 (0.53) ENPP1ALOX5RETFLT1KDR
SCHEMBL900656 0.74 SCN9A (0.49) HSD11B1SCN9AS1PR1
SCHEMBL906903 0.72 SMN1; SMN2 (0.50) MAPTHSD17B10
SCHEMBL4846484 0.71 TNF (0.47) ENPP1
SCHEMBL900780 0.70 ESR1 (0.39) ENPP1ALOX5HSD11B1MAPTS1PR1

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
US-9029357-B2 Benzazole derivatives as histamine H4 receptor ligands BIOPROJET (FR) 2015-05-12 US disclosed
US-20150004181-A1 Benzazole Derivatives as Histamine H4 Receptor Ligands BIOPROJET SOC CIV (FR) 2015-01-01 US disclosed
US-8802664-B2 Benzazole derivatives as histamine H4 receptor ligands BIOPROJECT (FR) 2014-08-12 US disclosed
US-20130231329-A1 Benzazole Derivatives as Histamine H4 Receptor Ligands BIOPROJET (FR) 2013-09-05 US disclosed
EP-2621916-A1 BENZAZOLE DERIVATIVES AS HISTAMINE H4 RECEPTOR LIGANDS BIOPROJET (FR) 2013-08-07 EP disclosed
WO-2012041860-A1 BENZAZOLE DERIVATIVES AS HISTAMINE H4 RECEPTOR LIGANDS BIOPROJET (FR) 2012-04-05 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 (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-20150004181-A1 Benzazole Derivatives as Histamine H4 Receptor Ligands HRH4, HRH3, HRH2 ENPP1 3557/4885ALOX5 3343/4885RET 529/4885
US-20130231329-A1 Benzazole Derivatives as Histamine H4 Receptor Ligands HRH4, HRH3, HRH2 ENPP1 3341/4885ALOX5 2210/4885RET 642/4885

“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.