SCHEMBL26225601

SCHEMBL26225601

NC1CC2(C1)CC(c1cc3cc(Cl)ccc3o1)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.40
KDM4E B2RXH2 5/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KDM1A O60341 3/20 0.37
ACHE P22303 1/20 0.37
HRH4 Q9H3N8 1/20 0.36
GPR35 Q9HC97 2/20 0.35
CYP1A2 P05177 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP2C9 P11712 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 2/20 0.35

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
SCHEMBL26226599 0.81 ACHE (0.45) MAOBKDM4ECA12CA1CA2
SCHEMBL26225600 0.79 MAOB (0.38) MAOBKDM4ECA12CA1CA2
SCHEMBL23175680 0.78 ACHE (0.50) MAOBKDM4ECA12CA1CA2
SCHEMBL23175437 0.75 MAOB (0.46) MAOBKDM4ECA12CA1CA2
SCHEMBL29568721 0.75 CYP1A2 (0.48) KDM4ENPC1RAB9AKDM1ACYP1A2
SCHEMBL24473707 0.75 CYP1A2 (0.48) KDM4ENPC1RAB9AKDM1ACYP1A2
SCHEMBL10901732 0.72 ACHE (0.65) MAOBKDM4ECA12CA1CA2
SCHEMBL30010802 0.72 ACHE (0.65) MAOBKDM4ECA12CA1CA2
SCHEMBL2721292 0.70 ACHE (0.52) MAOBNPC1RAB9AACHEHRH4
SCHEMBL29383343 0.70 ACHE (0.52) MAOBNPC1RAB9AACHEHRH4

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-20230286968-A1 ARYLOXAZOLO SPIRAL RING DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN-LA ROCHE INC. (US) 2023-09-14 US disclosed
US-20230286968-A1 ARYLOXAZOLO SPIRAL RING DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN-LA ROCHE INC. (US) 2023-09-14 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-20230286968-A1 ARYLOXAZOLO SPIRAL RING DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HAVCR2, CYP4B1, CYP1B1 MAOB 204/4885KDM4E 1715/4885CA12 4596/4885

“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.