SCHEMBL23978376

SCHEMBL23978376

CN1CCC(c2ccc(N)cc2CO)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 3/20 0.51
HTR1B P28222 3/20 0.51
QDPR P09417 2/20 0.40
WEE1 P30291 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
THPO P40225 1/20 0.39
ADRA2C P18825 1/20 0.38
HTR1F P30939 1/20 0.38
NR1H2 P55055 1/20 0.37
MAPT P10636 2/20 0.36
BLM P54132 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ACHE P22303 2/20 0.36
KDM4E B2RXH2 1/20 0.36
RAD52 P43351 1/20 0.36
DRD1 P21728 2/20 0.35
DRD2 P14416 1/20 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
SCHEMBL26040667 0.86 HTR1D (0.52) HTR1DHTR1BQDPRCYP1A2CYP3A4
SCHEMBL29310322 0.84 HTR1D (0.50) HTR1DHTR1BQDPRCYP1A2CYP3A4
SCHEMBL22542018 0.83 QDPR (0.41) HTR1DHTR1BQDPRWEE1CYP1A2
SCHEMBL13476645 0.82 NUDT1 (0.41) HTR1DHTR1BMAPTACHEKDM4E
SCHEMBL26640506 0.81 HTR1D (0.48) HTR1DHTR1BQDPRCYP1A2CYP3A4
SCHEMBL16825003 0.81 RBP4 (0.35) HTR1DHTR1BCYP2C9ACHE
SCHEMBL24478536 0.81 HTR2A (0.41) HTR1DHTR1BQDPRWEE1CYP1A2
SCHEMBL24451796 0.79 HTR2A (0.40) HTR1DHTR1BQDPRWEE1CYP1A2
SCHEMBL5140978 0.78 DRD2 (0.44) KDM4EDRD2
SCHEMBL522141 0.78 HTR1D (0.56) HTR1DHTR1BQDPRCYP1A2CYP3A4

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-20230192701-A1 BICYCLIC KINASE INHIBITORS AND USES THEREOF IOMX THERAPEUTICS AG (DE) 2023-06-22 US disclosed
WO-2021219731-A2 BICYCLIC KINASE INHIBITORS AND USES THEREOF IOMX THERAPEUTICS AG (DE) 2021-11-04 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-20230192701-A1 BICYCLIC KINASE INHIBITORS AND USES THEREOF MITF, PRKDC, PRKACA HTR1D 2745/4885HTR1B 3194/4885QDPR 3788/4885

“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.