SCHEMBL6090136

SCHEMBL6090136

Cc1cccc(C(=O)C=CC23CC4CC(CC(C4)C2)C3)n1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.43
GBA1 P04062 1/20 0.43
P2RX7 Q99572 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
GRM5 P41594 4/20 0.38
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.36
TP53 P04637 1/20 0.36
ATM Q13315 1/20 0.36
DUSP3 P51452 1/20 0.34
PTPN11 Q06124 1/20 0.34
FPR2 P25090 2/20 0.34

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
SCHEMBL4727194 0.80 CNR2 (0.46) NPC1MEN1KMT2AKDM4EALDH1A1
SCHEMBL4727008 0.80 CNR2 (0.46) NPC1MEN1KMT2AKDM4EALDH1A1
SCHEMBL4728914 0.78 RAB9A (0.51) NPC1P2RX7MEN1KMT2AKDM4E
SCHEMBL4731777 0.78 RAB9A (0.51) NPC1P2RX7MEN1KMT2AKDM4E
SCHEMBL6091141 0.75 FAAH (0.49) NPC1P2RX7MEN1KMT2AKDM4E
SCHEMBL18595247 0.73 P2RX7 (0.51) NPC1P2RX7MEN1KMT2AGRM5
SCHEMBL2638097 0.72 NPC1 (0.56) NPC1GBA1P2RX7GRM5KDM4E
SCHEMBL1769995 0.71 TSHR (0.56) P2RX7MEN1KMT2AALDH1A1TP53
SCHEMBL4728169 0.71 TSHR (0.56) P2RX7MEN1KMT2AALDH1A1TP53
SCHEMBL5505975 0.71 MEN1 (0.58) NPC1MEN1KMT2AKDM4EALDH1A1

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-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders MERZ PHARMA GMBH & CO. KGAA (DE) 2006-04-06 US claimed
US-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders MERZ PHARMA GMBH & CO. KGAA (DE) 2006-04-06 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-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders PMP22, ADCYAP1R1, CYP11B2 NPC1 245/4885GBA1 190/4885P2RX7 373/4885

“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.