SCHEMBL2845103

SCHEMBL2845103

Cc1ccc(-c2cc(C(N)=O)[nH]n2)cn1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 2/20 0.52
ALPL P05186 11/20 0.51
CA9 Q16790 3/20 0.49
MAPT P10636 5/20 0.48
RAB9A P51151 2/20 0.48
POLB P06746 1/20 0.48
ALDH1A1 P00352 2/20 0.46
GAA P10253 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CA12 O43570 4/20 0.45
LMNA P02545 1/20 0.45
RPA1 P27694 1/20 0.44
TP53 P04637 2/20 0.44
NPC1 O15118 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL29444415 0.83 ALPL (0.73) PLA2G10ALPLCA9MAPTRAB9A
SCHEMBL1856249 0.78 PRMT5 (0.45) ALPLCA9MAPTRAB9APOLB
SCHEMBL13162521 0.77 ALK (0.62) ALPLRAB9AALDH1A1GAANPC1
SCHEMBL2851890 0.77 ALDH1A1 (0.61) ALDH1A1TP53
SCHEMBL18726258 0.76 ACR (0.57) PLA2G10ALPLCA9MAPTRAB9A
SCHEMBL4638840 0.76 ALPL (0.73) PLA2G10ALPLCA12RPA1TP53
SCHEMBL2846632 0.76 ALPL (0.73) PLA2G10ALPLMAPTALDH1A1MEN1
SCHEMBL20661049 0.76 TP53 (0.51) PLA2G10ALPLCA9MAPTRAB9A
SCHEMBL2848443 0.76 ALPL (0.76) ALPLCA9MAPTRAB9APOLB
SCHEMBL29444426 0.76 SCN9A (0.57) PLA2G10ALPLCA9MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130474-A1 ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTOR INHIBITORS WYETH (US) 2010-05-27 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-20100130474-A1 ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTOR INHIBITORS CHRNA7, CHRNA6, CHRNA2 PLA2G10 2656/4885ALPL 4210/4885CA9 3775/4885

“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.