SCHEMBL4840229

SCHEMBL4840229

O=CNCc1cccc2cc(CN3CCCC3)ccc12

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 1/20 0.41
PRMT6 Q96LA8 1/20 0.40
CHKA P35790 1/20 0.40
MAPK1 P28482 1/20 0.40
MC5R P33032 1/20 0.40
CXCR4 P61073 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
ERN1 O75460 1/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C9 P11712 1/20 0.39
HIF1A Q16665 1/20 0.39
CYP2C19 P33261 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
NCF1 P14598 1/20 0.38
HRH3 Q9Y5N1 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
SCHEMBL4846896 0.99 SMN1; SMN2 (0.42) DPP8PRMT6CHKAMAPK1MC5R
SCHEMBL4840245 0.83 NCF1 (0.55) DPP8PRMT6CHKACXCR4SMN1; SMN2
SCHEMBL4846907 0.82 NCF1 (0.54) DPP8PRMT6CHKASMN1; SMN2TDP1
SCHEMBL4839252 0.79 MC5R (0.46) MAPK1MC5RKMT2A
SCHEMBL4844432 0.79 PRMT6 (0.58) PRMT6CHKASMN1; SMN2TDP1ALDH1A1
SCHEMBL4850098 0.78 MAPK1 (0.48) MAPK1MC5RKMT2A
SCHEMBL4850572 0.78 PRMT6 (0.56) PRMT6CHKASMN1; SMN2TDP1ALDH1A1
SCHEMBL5992743 0.77 PRMT6 (0.55) PRMT6SMN1; SMN2TDP1ALDH1A1CYP2D6
SCHEMBL4846770 0.76 MAPK1 (0.50) MAPK1MC5RKMT2A
SCHEMBL4840236 0.76 CYP2D6 (0.46) PRMT6CHKAMC5RSMN1; SMN2TDP1

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 DPP8 1551/4885PRMT6 3217/4885CHKA 4295/4885

“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.