SCHEMBL17876756

SCHEMBL17876756

CCc1nc2ccccn2c1C(=O)NCc1ccc(N(C)c2ccc(OC)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.67
SMN1; SMN2 Q16637 4/20 0.67
LMNA P02545 2/20 0.67
HTT P42858 2/20 0.67
PKM P14618 1/20 0.67
ALDH1A1 P00352 4/20 0.48
METTL3 Q86U44 2/20 0.47
MAPK1 P28482 2/20 0.46
CYP2C9 P11712 2/20 0.46
RAB9A P51151 1/20 0.46
HPGD P15428 3/20 0.46
CYP3A4 P08684 2/20 0.45
HSD17B10 Q99714 3/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TP53 P04637 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
THRB P10828 1/20 0.44
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL16447543 0.89 CYP2C9 (0.59) KDM4ESMN1; SMN2LMNAHTTPKM
SCHEMBL17876755 0.86 CYP2C9 (0.62) KDM4ESMN1; SMN2LMNAHTTPKM
SCHEMBL17876455 0.86 SMN1; SMN2 (0.66) KDM4ESMN1; SMN2LMNAHTTPKM
SCHEMBL17876754 0.85 CYP2C9 (0.62) KDM4ESMN1; SMN2LMNAHTTPKM
SCHEMBL12294854 0.84 SMN1; SMN2 (0.62) KDM4ESMN1; SMN2LMNAHTTPKM
SCHEMBL12294561 0.82 KDM4E (0.58) KDM4ESMN1; SMN2LMNAHTTPKM
SCHEMBL12294409 0.82 SMN1; SMN2 (0.60) KDM4ESMN1; SMN2LMNAHTTPKM
SCHEMBL12295260 0.82 CYP2C9 (0.58) KDM4ESMN1; SMN2LMNAHTTPKM
SCHEMBL12294652 0.82 CYP2C9 (0.66) KDM4ESMN1; SMN2LMNAHTTPKM
SCHEMBL12294653 0.81 KDM4E (0.58) KDM4ESMN1; SMN2LMNAHTTPKM

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-20160185774-A1 Anti-Infective Compounds INSTITUT PASTEUR KOREA (KR) 2016-06-30 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-20160185774-A1 Anti-Infective Compounds RABGGTB, ELANE, SERPINB1 KDM4E 4439/4885SMN1; SMN2 4839/4885LMNA 4132/4885

“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.