SCHEMBL5943465

SCHEMBL5943465

NC1CCCC(Nc2ccc3ccccc3n2)C1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.56
PIM1 P11309 8/20 0.46
PIM2 Q9P1W9 2/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NCF1 P14598 1/20 0.44
KDM1A O60341 1/20 0.43
PDE10A Q9Y233 4/20 0.42
CXCR3 P49682 1/20 0.39

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
SCHEMBL24092000 0.86 MCHR1 (0.57) MCHR1NPC1RAB9ADDB1CRBN
SCHEMBL29911218 0.86 MCHR1 (0.57) MCHR1NPC1RAB9ADDB1CRBN
SCHEMBL16666168 0.83 NPC1 (0.56) MCHR1NPC1RAB9ADDB1CRBN
SCHEMBL6456504 0.82 NCF1 (0.49) MCHR1PIM1PIM2NPC1RAB9A
SCHEMBL5943499 0.82 NCF1 (0.49) MCHR1PIM1PIM2NPC1RAB9A
SCHEMBL9056686 0.82 NPC1 (0.59) MCHR1NPC1RAB9ADDB1CRBN
SCHEMBL5431722 0.81 MCHR1 (0.59) MCHR1PIM1PIM2CXCR3
Hydrochloric Acid SCHEMBL6924108 0.81 NCF1 (0.47) MCHR1PIM1PIM2NPC1RAB9A
Hydrochloric Acid SCHEMBL6463442 0.81 NCF1 (0.47) MCHR1PIM1PIM2NPC1RAB9A
Hydrochloric Acid SCHEMBL8852766 0.80 NPC1 (0.57) MCHR1NPC1RAB9ADDB1CRBN

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-20060247439-A1 Mchir antagonists ASTRAZENECA AB (SE) 2006-11-02 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-20060247439-A1 Mchir antagonists MCHR1, HCRTR1, MC3R MCHR1 1/4885PIM1 2565/4885PIM2 3135/4885

“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.