SCHEMBL23364950

SCHEMBL23364950

CCC1(O)CCc2cccnc21

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
OPRL1 P41146 3/20 0.37
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
F2 P00734 2/20 0.33
KCNH2 Q12809 1/20 0.32
HRH1 P35367 1/20 0.32
SIGMAR1 Q99720 2/20 0.32
MTNR1A P48039 1/20 0.31
PDK2 Q15119 2/20 0.31
KDM1A O60341 1/20 0.31
NR3C1 P04150 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31

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
SCHEMBL15894659 1.00 CYP1A2 (0.41) CYP1A2CYP2C19KMT2AOPRL1ADRA2A
SCHEMBL23364949 1.00 CYP1A2 (0.41) CYP1A2CYP2C19KMT2AOPRL1ADRA2A
SCHEMBL23364947 0.90 CYP1A2 (0.39) CYP1A2CYP2C19KMT2AOPRL1ADRA2A
SCHEMBL15894663 0.90 CYP1A2 (0.39) CYP1A2CYP2C19KMT2AOPRL1ADRA2A
SCHEMBL15894671 0.84 CYP2C19 (0.41) CYP1A2CYP2C19KMT2AOPRL1ADRA2A
SCHEMBL15891606 0.84 OPRL1 (0.34) CYP1A2CYP2C19KMT2AOPRL1F2
SCHEMBL28955152 0.82 OPRL1 (0.33) OPRL1ADRA2AADRA2BADRA2CF2
SCHEMBL22743930 0.79 OPRL1 (0.46) CYP1A2CYP2C19KMT2AOPRL1KCNH2
SCHEMBL30656312 0.79 OPRL1 (0.46) CYP1A2CYP2C19KMT2AOPRL1KCNH2
SCHEMBL26836231 0.76 OPRL1 (0.34) CYP1A2CYP2C19KMT2AOPRL1DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260028363-A1 CHIRAL SYNTHESIS OF A TERTIARY ALCOHOL RECURIUM IP HOLDINGS LLC (US) 2026-01-29 US disclosed
US-12410204-B2 Chiral synthesis of a tertiary alcohol RECURIUM IP HOLDINGS, LLC (US) 2025-09-09 US disclosed
US-20230002426-A1 CHIRAL SYNTHESIS OF A TERTIARY ALCOHOL RECURIUM IP HOLDINGS, LLC 2023-01-05 US disclosed
EP-4045486-A1 CHIRAL SYNTHESIS OF A TERTIARY ALCOHOL Recurium IP Holdings, LLC (US) 2022-08-24 EP disclosed
WO-2021097139-A1 CHIRAL SYNTHESIS OF A TERTIARY ALCOHOL RECURIUM IP HOLDINGS, LLC (US) 2021-05-20 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 (3 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-12410204-B2 Chiral synthesis of a tertiary alcohol ADH1A, ADH1C, ADH5 CYP1A2 102/4885CYP2C19 919/4885KMT2A 3070/4885
US-20260028363-A1 CHIRAL SYNTHESIS OF A TERTIARY ALCOHOL ADH1A, ADH1C, ADH5 CYP1A2 193/4885CYP2C19 544/4885KMT2A 2872/4885
US-20230002426-A1 CHIRAL SYNTHESIS OF A TERTIARY ALCOHOL ADH1A, ADH1C, ADH5 CYP1A2 102/4885CYP2C19 919/4885KMT2A 3070/4885

“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.