SCHEMBL7200895

SCHEMBL7200895

CCC(N)(N)C(O)C(=O)c1ncc[nH]1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
KMT2A Q03164 1/20 0.34
HSPA5 P11021 1/20 0.34
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
F2RL1 P55085 2/20 0.30
FPR2 P25090 1/20 0.30

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
SCHEMBL647802 0.76 NPC1 (0.44) NPC1RAB9AKMT2AHSPA5PRMT5
SCHEMBL7196095 0.73 NPC1 (0.46) NPC1RAB9AKMT2AHSPA5PRMT5
SCHEMBL11599997 0.72 NPC1 (0.46) NPC1RAB9AKMT2AHSPA5
SCHEMBL28612372 0.72 NPC1 (0.46) NPC1RAB9AKMT2AHSPA5
SCHEMBL5161109 0.71 NPC1 (0.42) NPC1RAB9AKMT2AHSPA5FPR2
SCHEMBL6666888 0.71 NPC1 (0.49) NPC1RAB9AKMT2AHSPA5FPR2
SCHEMBL6281989 0.70 NPC1 (0.47) NPC1RAB9AKMT2AHSPA5
Hydrochloric Acid SCHEMBL17275457 0.70 NPC1 (0.45) NPC1RAB9AKMT2AHSPA5FPR2
Hydrochloric Acid SCHEMBL17275456 0.70 NPC1 (0.45) NPC1RAB9AKMT2AHSPA5FPR2
SCHEMBL7993393 0.70 NPC1 (0.41) NPC1RAB9AKMT2AHSPA5FPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6610663-B2 Antisense compound with targeting and RNA cleaving moieties, preferably an imidazole functionality conjugated to the targeting oligonucleotide via linkers ISIS PHARMACEUTICALS, INC. 2003-08-26 US disclosed
US-20020160972-A1 Compositions and methods for modulating RNA ISIS PHARMACEUTICALS, INC. 2002-10-31 US disclosed
US-6358931-B1 OLIGONUCLETIDE CONJUGATED TO IMIDAZOLE; INTERCALATION AND COORDINATION COMPOUNDS; MEDICAL DIAGNOSIS, GENE THERAPY; ANTISENSE AGENTS ISIS PHARMACEUTICALS, INC. 2002-03-19 US disclosed
US-5514786-A Compositions for inhibiting RNA activity ISIS PHARMACEUTICALS, INC. (US) 1996-05-07 US disclosed
EP-0656790-A1 COMPOSITIONS AND METHODS FOR MODULATING RNA ISIS PHARMACEUTICALS, INC. (US) 1995-06-14 EP disclosed
WO-1993017717-A1 COMPOSITIONS AND METHODS FOR MODULATING RNA ISIS PHARMACEUTICALS, INC. (US) 1993-09-16 WO 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-20020160972-A1 Compositions and methods for modulating RNA RNGTT, NSUN3, NSUN2 NPC1 3037/4885RAB9A 3848/4885KMT2A 1080/4885

“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.