SCHEMBL7110744

SCHEMBL7110744

NCC1(Cc2ccccc2)C=CC=CC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.40
MAOB P27338 8/20 0.40
KDM1A O60341 7/20 0.38
LOXL2 Q9Y4K0 2/20 0.34
RCOR1 Q9UKL0 3/20 0.33
TAAR1 Q96RJ0 2/20 0.32
CYP2A6 P11509 1/20 0.32
HTR2A P28223 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
EPHX1 P07099 1/20 0.31
DPP4 P27487 1/20 0.31
HSD11B1 P28845 1/20 0.30

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
SCHEMBL7894379 0.84 MAOA (0.37) MAOAMAOBKDM1AHSD11B1
SCHEMBL9120691 0.77 MAOA (0.46) MAOAMAOBKDM1ARCOR1HSD11B1
SCHEMBL9325850 0.77
SCHEMBL8838229 0.76 SLC7A5 (0.44) HSD11B1
SCHEMBL17414858 0.75 MAOA (0.47) MAOAMAOBKDM1ALOXL2RCOR1
SCHEMBL29274276 0.74 SIGMAR1 (0.41) KDM1ASMN1; SMN2
SCHEMBL11663054 0.74
SCHEMBL9530330 0.72 LTA4H (0.39)
SCHEMBL8155755 0.71 MAOA (0.38) MAOAMAOBKDM1AHSD11B1
SCHEMBL8907133 0.71 MAOA (0.38) MAOAMAOBKDM1AHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003062257-A1 DEAZAPURINE NUCLEOSIDE ANALOGS AND THEIR USE AS THERAPEUTIC AGENTS RIBAPHARM INC. (US) 2003-07-31 WO disclosed
WO-2003061576-A2 DEAZAPURINE NUCLEOSIDE ANALOGS AND THEIR USE AS THERAPEUTIC AGENTS RIBAPHARM INC. (US) 2003-07-31 WO disclosed
US-20020051991-A1 Rapid generation of diverse nucleoside and nucleotide libraries HONG ZHI (US) 2002-05-02 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-20020051991-A1 Rapid generation of diverse nucleoside and nucleotide libraries PNP, ADAR, SAMHD1 MAOA 2537/4885MAOB 1867/4885KDM1A 4635/4885

“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.