SCHEMBL10162463

SCHEMBL10162463

Fc1cc(C2CCNC2)ccc1N1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 4/20 0.44
PDE3A Q14432 4/20 0.44
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 2/20 0.42
TP53 P04637 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HTR3A P46098 1/20 0.41
KDR P35968 1/20 0.39
SYK P43405 1/20 0.39
TLR9 Q9NR96 2/20 0.38
TLR7 Q9NYK1 2/20 0.38
HRH3 Q9Y5N1 2/20 0.38
USP30 Q70CQ3 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL22325019 0.92 HPGD (0.44) PDE3BPDE3AHPGDSMN1; SMN2NPC1
SCHEMBL10163600 0.85 CYP2D6 (0.50) HPGDSMN1; SMN2TSHRMAPK1ALDH1A1
SCHEMBL10162461 0.79 HTR3A (0.53) HPGDSMN1; SMN2NPC1TP53ALOX15
SCHEMBL10162864 0.76 CYP2C19 (0.51) LMNA
SCHEMBL724585 0.75 HTR3A (0.59) HTR3A
SCHEMBL16660426 0.75 HTR3A (0.59) HTR3A
SCHEMBL22324888 0.72 PDE3B (0.40) PDE3BPDE3AHPGDSMN1; SMN2NPC1
SCHEMBL10162334 0.72 DDB1 (0.41) NPC1ALOX15RAB9ALMNA
SCHEMBL25333582 0.72 HRH3 (0.40) HRH3
SCHEMBL30501286 0.72 HRH3 (0.40) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120165320-A1 NOVEL AZABICYCLOHEXANES PANACEA BIOTEC LTD. (IN) 2012-06-28 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-20120165320-A1 NOVEL AZABICYCLOHEXANES CYP3A43, UGT1A1, CYP3A4 PDE3B 567/4885PDE3A 452/4885HPGD 443/4885

“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.