SCHEMBL14770642

SCHEMBL14770642

COc1ccc(C(C)c2nc3c(F)cccc3[nH]2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 4/20 0.40
▸ PLA2G2A P14555 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ GPR139 Q6DWJ6 2/20 0.39
▸ GAA P10253 4/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ AURKA O14965 1/20 0.36
▸ FLT3 P36888 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ DHODH Q02127 2/20 0.36
▸ MGAM O43451 3/20 0.36
▸ SI P14410 3/20 0.36
▸ MGAM2 Q2M2H8 3/20 0.36

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
SCHEMBL14770713 0.86 MLKL (0.45) PARP1PLA2G2AALOX15PTGS2GPR139
SCHEMBL14770624 0.81 AMY1A (0.40) GAA
SCHEMBL14770674 0.78 SMN1; SMN2 (0.56) GAAMEN1KMT2AKDM4ENPC1
SCHEMBL17910500 0.78 CYP1A2 (0.46) PARP1PLA2G2AALOX15PTGS2GAA
SCHEMBL14770630 0.77 AMY1A (0.42) MEN1KMT2AKDM4EALDH1A1
Hydrochloric Acid SCHEMBL17910659 0.77 CYP1A2 (0.45) PARP1PLA2G2AALOX15PTGS2GAA
SCHEMBL4118985 0.77 HSD17B10 (0.47) PARP1GAAKDM4EALDH1A1DHODH
SCHEMBL20900183 0.74 PARP1 (0.60) PARP1GAAALDH1A1SMN1; SMN2MGAM
SCHEMBL20900188 0.74 PARP1 (0.60) PARP1GAAALDH1A1SMN1; SMN2MGAM
SCHEMBL14770492 0.74 AMY1A (0.41) MEN1KMT2AFLT3KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9096531-B2 Fused imidazole derivative TOA EIYO LTD. (JP) 2015-08-04 — — US disclosed
US-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE TOA EIYO LTD. (JP) 2013-03-14 — — 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-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE CACNA1E, CACNA1G, CACNA1A PARP1 4644/4885PLA2G2A 1777/4885ALOX15 4596/4885

“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.

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