SCHEMBL4983028

SCHEMBL4983028

CC(C)(C)c1ccc(C(=O)N2CCc3[c]nc(C(N)=O)nc3C2)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HTT P42858 2/20 0.44
ALDH1A1 P00352 2/20 0.44
ALOX15 P16050 1/20 0.43
TRPV1 Q8NER1 1/20 0.40
GBA1 P04062 4/20 0.40
LMNA P02545 2/20 0.39
THRB P10828 1/20 0.39
ABL1 P00519 1/20 0.39
BCR P11274 1/20 0.39
TRPC6 Q9Y210 1/20 0.38
C5AR1 P21730 1/20 0.38
MITF O75030 1/20 0.37

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
SCHEMBL4989566 0.89 GAA (0.45) HPGDMEN1KMT2A
SCHEMBL4990813 0.88 PKM (0.42) HPGDMEN1KMT2AHTTALDH1A1
SCHEMBL4982974 0.86 GRM5 (0.45)
SCHEMBL4988052 0.86 HSP90AB1 (0.42) HPGDKMT2AALDH1A1
SCHEMBL4985620 0.85 PTGS1 (0.43) HPGD
SCHEMBL4987144 0.85 CYP2C9 (0.40) HPGDSMN1; SMN2MEN1KMT2AHTT
SCHEMBL4989543 0.85 HPGD (0.45) HPGDALDH1A1
SCHEMBL4984723 0.84 GRM5 (0.43) ALDH1A1
SCHEMBL4993556 0.82 EPHX2 (0.42)
SCHEMBL4989388 0.81 MAPK1 (0.55) HPGDSMN1; SMN2MEN1KMT2AHTT

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 HPGD 368/4885SMN1; SMN2 4369/4885MEN1 4853/4885

“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.