SCHEMBL6751102

SCHEMBL6751102

O=C(CCl)c1cc2c3c(c1)CCC(=O)N3CCC2

nearest known ligand 0.84

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.84
TTR P02766 1/20 0.84
ACHE P22303 2/20 0.55
KMT2A Q03164 2/20 0.53

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
SCHEMBL18121772 0.91 NPC1 (0.70) NPC1TTRACHEKMT2A
SCHEMBL18823571 0.89 NPC1 (0.71) NPC1TTRACHE
SCHEMBL4860547 0.85 NPC1 (0.67) NPC1TTRACHE
SCHEMBL4851995 0.80 NPC1 (0.60) NPC1TTRACHE
SCHEMBL4860249 0.80 NPC1 (0.59) NPC1TTRACHE
SCHEMBL6743887 0.80 NPC1 (0.66) NPC1TTRACHEKMT2A
SCHEMBL4855388 0.79 NPC1 (0.76) NPC1TTRACHE
SCHEMBL4853290 0.78 NPC1 (0.56) NPC1TTRACHE
SCHEMBL14301290 0.77 NPC1 (0.75) NPC1TTRACHEKMT2A
SCHEMBL4861818 0.77 NPC1 (0.55) NPC1TTRACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3372600-B1 FUSED HETEROCYCLIC COMPOUND DERIVATIVE AND APPLICATION THEREOF NHWA PHARMA CORP (CN) 2021-09-08 EP disclosed
WO-2017071576-A1 FUSED HETEROCYCLIC COMPOUND DERIVATIVE AND APPLICATION THEREOF 江苏恩华药业股份有限公司 2017-05-04 WO disclosed
US-20040138230-A1 Heterocyclic substituted piperazines for the treatment of schizophrenia ANDREANA TONJA LYNN (US) 2004-07-15 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-20040138230-A1 Heterocyclic substituted piperazines for the treatment of schizophrenia CNR1, DRD2, CNR2 NPC1 2509/4885TTR 4604/4885ACHE 805/4885

“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.