SCHEMBL16797803

SCHEMBL16797803

NCCc1cn2cc(Cl)ccc2n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.59
TP53 P04637 1/20 0.59
NPC1 O15118 9/20 0.54
RAB9A P51151 9/20 0.54
SMN1; SMN2 Q16637 5/20 0.54
ALDH1A1 P00352 5/20 0.54
MAPT P10636 5/20 0.54
POLB P06746 2/20 0.54
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
PKM P14618 2/20 0.48
CYP2C19 P33261 1/20 0.48
PDE10A Q9Y233 1/20 0.46
TDP1 Q9NUW8 2/20 0.45
ABL1 P00519 1/20 0.45
RIN1 Q13671 1/20 0.45
HIF1A Q16665 1/20 0.45
GAA P10253 1/20 0.44
NR4A1 P22736 1/20 0.44
MAPK1 P28482 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
SCHEMBL17221244 0.86 KDM4E (0.63) KDM4ETP53NPC1RAB9ASMN1; SMN2
SCHEMBL16797813 0.83 KDM4E (0.59) KDM4ETP53NPC1RAB9ASMN1; SMN2
SCHEMBL1543264 0.81 NPC1 (0.47) KDM4ETP53NPC1RAB9ASMN1; SMN2
SCHEMBL286467 0.80 KDM4E (0.65) KDM4ETP53NPC1RAB9ASMN1; SMN2
SCHEMBL16797795 0.79 PIK3CG (0.56) KDM4ETP53NPC1RAB9ASMN1; SMN2
SCHEMBL9570213 0.79 KDM4E (0.63) KDM4ETP53NPC1RAB9ASMN1; SMN2
SCHEMBL13059011 0.79 KDM4E (0.63) KDM4ETP53NPC1RAB9ASMN1; SMN2
SCHEMBL8814958 0.79 KDM4E (0.68) KDM4ETP53NPC1RAB9ASMN1; SMN2
SCHEMBL9598420 0.79 KDM4E (0.63) KDM4ETP53NPC1RAB9ASMN1; SMN2
SCHEMBL16424527 0.75 KDM4E (1.00) KDM4ETP53NPC1RAB9ASMN1; SMN2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3080114-B1 FUSED TRICYCLIC IMIDAZOLE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL (BE) 2019-10-02 EP disclosed
US-9890174-B2 Fused Tricyclic imidazole derivatives as modulators of TNF activity UCB BIOPHARMA SPRL (BE) 2018-02-13 US disclosed
US-20160304530-A1 Fused Tricyclic Imidazole Derivatives As Modulators of TNF Activity UCB PHARMA S.A. (BE) 2016-10-20 US disclosed
EP-3080114-A1 FUSED TRICYCLIC IMIDAZOLE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SPRL (BE) 2016-10-19 EP disclosed
WO-2015086527-A1 FUSED TRICYCLIC IMIDAZOLE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL (BE) 2015-06-18 WO 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-20160304530-A1 Fused Tricyclic Imidazole Derivatives As Modulators of TNF Activity TNF, TNFRSF1A, TNFRSF9 KDM4E 3730/4885TP53 460/4885NPC1 3347/4885

“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.