SCHEMBL4160380

SCHEMBL4160380

Cc1cc[c]c(C(=O)N2Cc3ccccc3C2)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 15/20 0.46
HSP90AB1 P08238 7/20 0.46
HSP90B1 P14625 2/20 0.46
TRAP1 Q12931 2/20 0.46
NOTUM Q6P988 1/20 0.46
NAMPT P43490 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
TAS1R2 Q8TE23 1/20 0.43
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL10399266 0.80 HPGD (0.51) ALDH1A1HPGDRAB9A
SCHEMBL28946280 0.76 SIGMAR1 (0.45) HSP90AA1HPGD
SCHEMBL10399284 0.76 HPGD (0.48) ALDH1A1CYP2C9HPGDCYP2C19HTT
SCHEMBL28799060 0.75 HPGD (0.51) ALDH1A1HPGDRAB9A
SCHEMBL28799044 0.74 KDM1A (0.42) ALDH1A1HPGD
SCHEMBL12569373 0.73 HPGD (0.64) HSP90AA1HSP90AB1HSP90B1TRAP1NAMPT
SCHEMBL4156420 0.72 HDAC1 (0.44) HSP90AA1HSP90AB1HSP90B1TRAP1NAMPT
SCHEMBL28799050 0.71 KDM1A (0.44)
SCHEMBL4145940 0.71 HSP90AA1 (0.72) HSP90AA1HSP90AB1HSP90B1TRAP1
SCHEMBL4163325 0.71 TRAP1 (0.70) HSP90AA1HSP90AB1HSP90B1TRAP1

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-20090215742-A1 AMIDE RESORCINOL COMPOUNDS PFIZER, INC. 2009-08-27 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-20090215742-A1 AMIDE RESORCINOL COMPOUNDS HSP90AB1, HSP90AA1, HSP90AB2P HSP90AA1 2/4885HSP90AB1 1/4885HSP90B1 4/4885

“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.