SCHEMBL26837307

SCHEMBL26837307

Fc1ccc2c3c([nH]c2c1)C1CCCN(CC3)C1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 3/20 0.41
▸ HTR2C P28335 3/20 0.41
▸ KCNH2 Q12809 2/20 0.41
▸ DRD2 P14416 1/20 0.40
▸ BRD3 Q15059 7/20 0.39
▸ ADRA1A P35348 2/20 0.38
▸ ADRA1D P25100 1/20 0.38
▸ ADRA1B P35368 1/20 0.38
▸ RB1 P06400 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ ABCB1 P08183 1/20 0.36
▸ ABCG2 Q9UNQ0 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ RAB9A P51151 1/20 0.36

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
SCHEMBL26837287 0.85 ALOX15 (0.40) HTR2AHTR2CADRA1AADRA1DADRA1B
SCHEMBL26837253 0.85 KDM4E (0.45) HTR2AHTR2CDRD2BRD3ADRA1A
SCHEMBL26837263 0.85 SIRT1 (0.39) ADRA1AADRA1DADRA1BLMNAABCG2
SCHEMBL26837304 0.85 ADRA1D (0.34) HTR2AHTR2CBRD3ADRA1AADRA1D
SCHEMBL26840037 0.84 MAPK10 (0.42) ADRA1AADRA1DADRA1BABCG2KDM4E
SCHEMBL26675949 0.83 ADRA1D (0.56) BRD3ADRA1AADRA1DADRA1BRB1
SCHEMBL26837357 0.82 KDM4E (0.52) HTR2AHTR2CKCNH2LMNAABCB1
SCHEMBL26837255 0.82 ADRA1D (0.36) DRD2BRD3ADRA1AADRA1DADRA1B
SCHEMBL26837291 0.81 BRD3 (0.35) BRD3ADRA1AADRA1DADRA1BKDM4E
SCHEMBL26837299 0.80 PARP1 (0.31) —

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 HTR2A 133/4885HTR2C 126/4885KCNH2 326/4885

“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.

Send feedback