SCHEMBL4839401

SCHEMBL4839401

NC(=O)c1cccc2cc(CN3CC3)ccc12

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.51
MEN1 O00255 4/20 0.51
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.50
MC4R P32245 1/20 0.50
MC5R P33032 1/20 0.50
PARP1 P09874 6/20 0.49
PARP2 Q9UGN5 4/20 0.49
PARP3 Q9Y6F1 4/20 0.49
POLB P06746 1/20 0.47
TBXAS1 P24557 1/20 0.47
PKM P14618 1/20 0.47

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
SCHEMBL4844426 0.94 PARP1 (0.56) KMT2AMEN1KDM4EALDH1A1GAA
SCHEMBL4850567 0.93 PARP1 (0.57) KMT2AMEN1KDM4EALDH1A1GAA
SCHEMBL4841013 0.91 PARP1 (0.58) KMT2AKDM4EALDH1A1PARP1PARP2
SCHEMBL4848459 0.91 GRM2 (0.50) KMT2AMEN1KDM4EALDH1A1GAA
SCHEMBL4847358 0.80 KDM4E (0.57) KDM4EALDH1A1GAAPARP1POLB
SCHEMBL4840236 0.76 CYP2D6 (0.46) KMT2AMEN1ALDH1A1MC4RMC5R
SCHEMBL4846986 0.75 PARP1 (0.53) KDM4EALDH1A1GAAPARP1PARP2
SCHEMBL4848291 0.75 PARP1 (0.52) KDM4EALDH1A1GAAPARP1PARP2
SCHEMBL4846900 0.75 CYP2D6 (0.48) KMT2AMEN1ALDH1A1MC4RMC5R
SCHEMBL4839412 0.75 KMT2A (0.51) KMT2AMEN1MC4RMC5RPKM

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
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 KMT2A 2587/4885MEN1 330/4885KDM4E 2926/4885

“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.