SCHEMBL26837612

SCHEMBL26837612

COc1ccc2oc3c(c2c1)CCN1CCCC3C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 2/20 0.41
▸ KDM4E B2RXH2 4/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ HPGD P15428 4/20 0.40
▸ NPC1 O15118 4/20 0.40
▸ RAB9A P51151 4/20 0.40
▸ MAPT P10636 3/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ CASP3 P42574 1/20 0.40
▸ SENP8 Q96LD8 1/20 0.40
▸ SENP7 Q9BQF6 1/20 0.40
▸ SENP6 Q9GZR1 1/20 0.40
▸ MAOA P21397 1/20 0.39
▸ MTNR1A P48039 1/20 0.38
▸ MTNR1B P49286 1/20 0.38
▸ HSD17B10 Q99714 3/20 0.38
▸ PRKDC P78527 1/20 0.38
▸ CDC7 O00311 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ USP2 O75604 1/20 0.37

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
SCHEMBL26837240 0.81 CYP1A2 (0.47) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL26837238 0.81 HTR3A (0.38) HRH4ALDH1A1NPC1RAB9AMAPT
SCHEMBL26837244 0.79 CYP3A4 (0.39) SMN1; SMN2POLBACHE
SCHEMBL26837242 0.79 CHRM2 (0.37) NPC1RAB9AMAOAMEN1KMT2A
SCHEMBL26837609 0.77 MAOA (0.40) HRH4KDM4EALDH1A1HPGDNPC1
SCHEMBL26017542 0.75 MAPKAPK2 (0.41) KDM4EALDH1A1NPC1RAB9AMAPT
SCHEMBL26675972 0.75 MAPKAPK2 (0.54) KDM4EALDH1A1MAPTSMN1; SMN2MTNR1A
SCHEMBL29736188 0.75 MAPKAPK2 (0.54) KDM4EALDH1A1MAPTSMN1; SMN2MTNR1A
SCHEMBL26837357 0.73 KDM4E (0.52) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL19630854 0.72 SLC6A4 (0.42) HRH4KDM4EALDH1A1HPGDNPC1

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-20230382919-A1 OXA- IBOGAINE INSPIRED ANALOGUES FOR TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2023-11-30 — — US disclosed
US-20230382919-A1 OXA- IBOGAINE INSPIRED ANALOGUES FOR TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2023-11-30 — — 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-20230382919-A1 OXA- IBOGAINE INSPIRED ANALOGUES FOR TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS GRIA4, GRIA3, GRIN3A HRH4 37/4885KDM4E 2836/4885ALDH1A1 2437/4885

“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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