SCHEMBL1942633

SCHEMBL1942633

COCCn1c(C)nc2cc(C(=O)N(C)C)c(CN(C)C)c(O)c21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 3/20 0.35
BRD4 O60885 2/20 0.34
LMNA P02545 4/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
HTT P42858 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
GALR3 O60755 1/20 0.32
ALDH1A1 P00352 2/20 0.32
CYP1A2 P05177 2/20 0.32
CASP1 P29466 2/20 0.32
CASP7 P55210 2/20 0.32
HSD17B10 Q99714 1/20 0.32
SYK P43405 1/20 0.31
CDK9 P50750 1/20 0.31
DYRK1A Q13627 1/20 0.31
DYRK2 Q92630 1/20 0.31
CLK4 Q9HAZ1 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
SCHEMBL1941310 0.89 KDM4E (0.36) PTGER4BRD4LMNASMN1; SMN2NPC1
SCHEMBL1943175 0.89 LMNA (0.33) PTGER4BRD4LMNASMN1; SMN2NPC1
SCHEMBL1943290 0.80 ALDH1A1 (0.37) PTGER4LMNASMN1; SMN2NPC1RAB9A
SCHEMBL1942717 0.79 MAPT (0.33) PTGER4LMNAMEN1KMT2AALDH1A1
SCHEMBL1943217 0.77 PTGER4 (0.44) PTGER4BRD4LMNASMN1; SMN2NPC1
SCHEMBL1942639 0.71 ACKR3 (0.36) PTGER4LMNASMN1; SMN2NPC1RAB9A
SCHEMBL4574787 0.69 MEN1 (0.33) LMNAMEN1KMT2AALDH1A1CDK9
SCHEMBL1942719 0.69 MGAT2 (0.31)
SCHEMBL1942293 0.68 TSHR (0.38) PTGER4LMNASMN1; SMN2NPC1RAB9A
SCHEMBL1942259 0.68 PTGER4 (0.35) PTGER4BRD4LMNASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8466166-B2 Benzimidazole derivatives as selective acid pump inhibitors RAQUALIA PHARMA INC. (JP) 2013-06-18 US disclosed
EP-2081939-B1 BENZIMIDAZOLE DERIVATIVES AS SELECTIVE ACID PUMP INHIBITORS RAQUALIA PHARMA INC (JP) 2011-06-15 EP disclosed
US-20100048532-A1 Benzimidazole Derivatives as Selective Acid Pump Inhibitors RAQUALIA PHARMA INC. (JP) 2010-02-25 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-20100048532-A1 Benzimidazole Derivatives as Selective Acid Pump Inhibitors HRH2, HRH4, HRH1 PTGER4 39/4885BRD4 252/4885LMNA 4475/4885

“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.