SCHEMBL4846907

SCHEMBL4846907

CNCc1cccc2cc(CN3CCCCC3)ccc12

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.46
POLB P06746 1/20 0.46
CHKA P35790 1/20 0.45
ALDH1A1 P00352 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
DPP8 Q6V1X1 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL4840245 0.99 NCF1 (0.55) NCF1SMN1; SMN2POLBCHKAALDH1A1
SCHEMBL4846896 0.84 SMN1; SMN2 (0.42) SMN1; SMN2POLBCHKAALDH1A1TDP1
SCHEMBL4850572 0.82 PRMT6 (0.56) SMN1; SMN2POLBCHKAALDH1A1TDP1
SCHEMBL4840229 0.82 DPP8 (0.41) NCF1SMN1; SMN2CHKAALDH1A1TDP1
SCHEMBL4844432 0.81 PRMT6 (0.58) NCF1SMN1; SMN2POLBCHKAALDH1A1
SCHEMBL4846900 0.77 CYP2D6 (0.48) SMN1; SMN2ALDH1A1TDP1CYP2D6CYP2C19
SCHEMBL4840236 0.75 CYP2D6 (0.46) SMN1; SMN2CHKAALDH1A1TDP1CYP2D6
SCHEMBL1936431 0.75 NCF1 (0.69) NCF1SMN1; SMN2ALDH1A1TDP1CYP2D6
SCHEMBL22957889 0.75 ALDH1A1 (0.58) NCF1SMN1; SMN2POLBALDH1A1HRH3
SCHEMBL4839412 0.75 KMT2A (0.51) NCF1CHKADPP8PRMT6

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
US-7368462-B1 Melanin concentrating hormone antagonists THE PROCTER & GAMBLE COMPANY (US) 2008-05-06 US claimed
US-7368462-B1 Melanin concentrating hormone antagonists THE PROCTER & GAMBLE COMPANY (US) 2008-05-06 US disclosed
US-20080058423-A1 Melanin concentrating hormone antagonists THE PROCTER & GAMBLE COMPANY 2008-03-06 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-20080058423-A1 Melanin concentrating hormone antagonists MCHR1, MCHR2, MC4R NCF1 1524/4885SMN1; SMN2 4681/4885POLB 4797/4885

“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.