SCHEMBL4892997

SCHEMBL4892997

C[C@@H]1C[C@H](C)CN(C(=O)N(C(=O)CNC(=O)c2ccccc2)c2ccc(Cl)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
CCR2 P41597 3/20 0.42
GPR139 Q6DWJ6 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PLA2G1B P04054 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
MEN1 O00255 1/20 0.41
HPGD P15428 1/20 0.41
SLC6A9 P48067 2/20 0.40
SLC6A5 Q9Y345 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 1/20 0.39
OPRK1 P41145 1/20 0.38
CCR1 P32246 2/20 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
SCHEMBL4896093 0.90 KMT2A (0.46) KMT2AKDM4EALDH1A1PLA2G1BATG4B
SCHEMBL4887565 0.86 SLC6A9 (0.43) KMT2AKDM4EALDH1A1MEN1HPGD
SCHEMBL4892547 0.84 ALDH1A1 (0.40) KMT2AKDM4EALDH1A1MEN1HPGD
SCHEMBL4894897 0.83 KMT2A (0.44) KMT2AKDM4EALDH1A1MEN1HPGD
SCHEMBL4887013 0.82 KMT2A (0.40) KMT2AKDM4EALDH1A1PLA2G1BATG4B
SCHEMBL4893181 0.79 THRB (0.43) KMT2AKDM4EALDH1A1MEN1SMN1; SMN2
SCHEMBL4883922 0.79 RAB9A (0.50) KMT2AALDH1A1MEN1HPGDSMN1; SMN2
SCHEMBL4882730 0.79 THRB (0.42) KMT2AKDM4EALDH1A1MEN1
SCHEMBL4892647 0.73 KDM4E (0.45) KMT2AKDM4EALDH1A1MEN1HPGD
SCHEMBL4892456 0.73 THRB (0.38) KMT2AKDM4EALDH1A1MEN1

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-20080200512-A1 Hepatitis C virus polymerase inhibitors BLANEY JEFFREY MARK 2008-08-21 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-20080200512-A1 Hepatitis C virus polymerase inhibitors SSU72, POLR2H, POLR2E KMT2A 2650/4885CCR2 741/4885GPR139 2236/4885

“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.