SCHEMBL4983032

SCHEMBL4983032

CC(C)(C)c1ccc(C(=O)N2CCc3c(N)ncnc3C2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
HTT P42858 2/20 0.48
TRPV1 Q8NER1 1/20 0.47
HPGD P15428 2/20 0.47
ALOX15 P16050 1/20 0.47
ABL1 P00519 1/20 0.44
BCR P11274 1/20 0.44
GBA1 P04062 3/20 0.42
MAPK1 P28482 1/20 0.42
MAPK7 Q13164 1/20 0.40
MITF O75030 1/20 0.40
TRPC6 Q9Y210 1/20 0.40
MAPT P10636 1/20 0.40
KDM4E B2RXH2 1/20 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
SCHEMBL4989574 0.88 MEN1 (0.48) MEN1KMT2AHPGD
SCHEMBL4990817 0.87 PKM (0.46) ALDH1A1MEN1KMT2AHTTHPGD
SCHEMBL4988057 0.84 P2RX7 (0.45) ALDH1A1HPGD
SCHEMBL4982979 0.84 GRM5 (0.50) ABL1BCR
SCHEMBL4985624 0.84 P2RX7 (0.49) ALDH1A1HPGD
SCHEMBL4989547 0.84 HPGD (0.49) ALDH1A1KMT2AHPGD
SCHEMBL4987150 0.84 SLC6A7 (0.44) HPGD
SCHEMBL4984728 0.81 GRM5 (0.47) ALDH1A1MAPK7MAPT
SCHEMBL4993564 0.81 EPHX2 (0.45) MAPK7
SCHEMBL4986041 0.79 HPGD (0.49) HPGD

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-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof RENOVIS, INC. 2008-02-14 US claimed

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-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof P2RX7, P2RX3, P2RX2 ALDH1A1 3640/4885MEN1 4853/4885KMT2A 4614/4885

“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.