SCHEMBL13510883

SCHEMBL13510883

Cc1ccc(CC2(N)CCN(C)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
OPRM1 P35372 2/20 0.42
HRH3 Q9Y5N1 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
HTR6 P50406 1/20 0.38
MAPT P10636 2/20 0.38
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
TP53 P04637 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
HRH1 P35367 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
SCHEMBL23601588 0.85 MAOA (0.61) MAOAMAOBHRH3MAPTGRIN2D
SCHEMBL8267927 0.84 AKT2 (0.49) MAOAMAOBOPRM1HTR6LMNA
SCHEMBL8267929 0.84 MAOA (0.68) MAOAMAOBOPRM1KMT2A
SCHEMBL16380618 0.81 AKT2 (0.53) MAOAMAOBROCK2CYP2C9AKT2
SCHEMBL23660672 0.81 MAOA (0.44) MAOAMAOBHRH3HTR6ALDH1A1
SCHEMBL12038285 0.79 MAOA (0.50) MAOAMAOBHRH3KMT2AHRH1
SCHEMBL13231735 0.79 GRIN2D (0.57) OPRM1HRH3KMT2AMEN1MAPT
SCHEMBL13510887 0.76 AKT2 (0.53) MAOAMAOBOPRM1HRH3KMT2A
SCHEMBL28551933 0.75 MAOB (0.46) MAOAMAOBMAPTGRIN2DGRIN3B
SCHEMBL23660648 0.72 KDM4E (0.48) MAOAMAOBHRH3ALDH1A1

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
WO-2023152337-A1 AN IGF1R INHIBITOR AND AN AKT INHIBITOR FOR USE IN THE TREATMENT OF CANCER GENOME RESEARCH LIMITED (GB) 2023-08-17 WO disclosed
US-20100016340-A1 PHARMACEUTICAL COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2010-01-21 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-20100016340-A1 PHARMACEUTICAL COMPOUNDS PKN2, PKN1, CSNK1A1 MAOA 2217/4885MAOB 1311/4885OPRM1 309/4885

“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.