SCHEMBL26734061

SCHEMBL26734061

COc1ccc2c(ccc3c2cc2c4ccc(OC)cc4ccc2[n+]3Cc2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 0.56
▸ NPC1 O15118 3/20 0.49
▸ RAB9A P51151 3/20 0.49
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2A6 P11509 1/20 0.45
▸ PPM1A P35813 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ NOD2 Q9HC29 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40
▸ RELA Q04206 1/20 0.40

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
SCHEMBL26734063 0.92 PPM1A (0.46) ACHENPC1RAB9ACYP1A2CYP2A6
SCHEMBL26733745 0.82 ACHE (0.41) ACHENPC1RAB9APPM1AKDM4E
SCHEMBL26733736 0.79 ALDH1A1 (0.57) NPC1RAB9ACYP2A6KDM4EALDH1A1
SCHEMBL26734006 0.78 CYP1A2 (0.49) ACHENPC1RAB9ACYP1A2CYP2A6
SCHEMBL27902298 0.73 CYP2A6 (0.65) NPC1RAB9ACYP1A2CYP2A6KDM4E
SCHEMBL26733776 0.72 PPM1A (0.46) ACHENPC1RAB9ACYP1A2CYP2A6
SCHEMBL9040087 0.71 CYP1A2 (0.72) NPC1RAB9ACYP1A2CYP2A6KDM4E
SCHEMBL12259995 0.71 CYP2A6 (0.62) NPC1RAB9ACYP1A2CYP2A6KDM4E
SCHEMBL3137389 0.71 CYP2A6 (0.62) NPC1RAB9ACYP1A2CYP2A6KDM4E
SCHEMBL12277498 0.71 CYP2A6 (0.62) NPC1RAB9ACYP1A2CYP2A6KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230339862-A1 NOVEL DIBENZOACRIDINIUM DERIVATIVES, THEIR PROCESS OF PREPARATION AND THEIR USE FOR TREATING VIRAL INFECTIONS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2023-10-26 — — 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-20230339862-A1 NOVEL DIBENZOACRIDINIUM DERIVATIVES, THEIR PROCESS OF PREPARATION AND THEIR USE FOR TREATING VIRAL INFECTIONS DDX41, DDX42, EWSR1 ACHE 3239/4885NPC1 3451/4885RAB9A 1789/4885

“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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