SCHEMBL31200507

SCHEMBL31200507

CC(C)(C)OC(=O)N1CC(N2CCCC(C(=O)Nc3nc4c(F)cc(F)cc4s3)C2)C1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 7/20 0.58
▸ RAB9A P51151 7/20 0.58
▸ CHKA P35790 1/20 0.47
▸ MAPT P10636 5/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ POLB P06746 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ PKM P14618 1/20 0.44
▸ CYP2D6 P10635 2/20 0.40
▸ CCR3 P51677 2/20 0.40
▸ NTRK1 P04629 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ AGTR1 P30556 1/20 0.39
▸ OPRK1 P41145 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CLK1 P49759 1/20 0.38
▸ TP53 P04637 1/20 0.38

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
SCHEMBL31419727 0.95 NPC1 (0.56) NPC1RAB9ACHKAMAPTL3MBTL1
SCHEMBL31200478 0.92 NPC1 (0.47) NPC1RAB9ACHKAMAPTL3MBTL1
SCHEMBL31389076 0.91 NPC1 (0.62) NPC1RAB9ACHKAMAPTL3MBTL1
SCHEMBL25528395 0.91 NPC1 (0.62) NPC1RAB9ACHKAMAPTL3MBTL1
SCHEMBL25209406 0.91 NPC1 (0.62) NPC1RAB9ACHKAMAPTL3MBTL1
SCHEMBL24071502 0.91 NPC1 (0.62) NPC1RAB9ACHKAMAPTL3MBTL1
SCHEMBL31200451 0.91 NPC1 (0.62) NPC1RAB9ACHKAMAPTL3MBTL1
SCHEMBL31389071 0.91 NPC1 (0.62) NPC1RAB9ACHKAMAPTL3MBTL1
SCHEMBL31419703 0.89 NPC1 (0.61) NPC1RAB9ACHKAMAPTL3MBTL1
SCHEMBL24071450 0.88 NPC1 (0.65) NPC1RAB9ACHKAMAPTL3MBTL1

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-20250092030-A1 ENHANCERS OF PARTICULATE GUANYLYL CYCLASE RECEPTOR A MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2025-03-20 — — US disclosed
WO-2024233501-A2 THERAPEUTIC COMPOUNDS ALLOROCK, INC. (US) 2024-11-14 — — 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-20250092030-A1 ENHANCERS OF PARTICULATE GUANYLYL CYCLASE RECEPTOR A PDE2A, GUCY1A1, GCGR NPC1 1065/4885RAB9A 960/4885CHKA 2381/4885

“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.

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