SCHEMBL3769314

SCHEMBL3769314

[c]1ccccc1NCc1ccco1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
KCNH3 Q9ULD8 1/20 0.46
MAPK1 P28482 5/20 0.44
LMNA P02545 3/20 0.44
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
PKM P14618 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
HTT P42858 3/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
BLM P54132 1/20 0.44
USP2 O75604 1/20 0.42

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
SCHEMBL9536836 0.74 KCNH3 (0.47) KMT2ARAB9ANPC1KCNH3MAPK1
SCHEMBL3761931 0.72 ALDH1A1 (0.45) KMT2AKCNH3MAPK1LMNAKDM4E
SCHEMBL2805209 0.72 ALDH1A1 (0.68) KMT2ARAB9ANPC1KCNH3MAPK1
SCHEMBL693665 0.72 HSD17B10 (0.47) KMT2AKDM4EHPGDTSHRHSD17B10
SCHEMBL10408359 0.71 KMT2A (0.56) KMT2ARAB9ANPC1KCNH3MAPK1
SCHEMBL15455447 0.71 ALDH1A1 (0.54) KMT2ARAB9ANPC1KCNH3MAPK1
SCHEMBL1900175 0.70 HPGD (0.56) KMT2ARAB9ANPC1LMNAALDH1A1
SCHEMBL28689647 0.70 KMT2A (0.51) KMT2ARAB9ANPC1KCNH3MAPK1
SCHEMBL8731748 0.69 ALDH1A1 (0.35) KMT2AKCNH3MAPK1LMNAKDM4E
SCHEMBL843371 0.68 CHRM2 (0.69) KMT2AALDH1A1GAATSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2029570-B1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2014-10-15 EP disclosed
US-8324204-B2 Fused thiophene derivatives as kinase inhibitors UCB PHARMA SA (BE) 2012-12-04 US disclosed
US-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-12-02 US disclosed
WO-2009122148-A1 FUSED THIOPHENE AND THIAZOLE DERIVATIVES AS PI3K KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-10-08 WO disclosed
WO-2009071890-A1 TRICYCLIC KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
WO-2009071895-A1 FUSED THIAZOLE AND THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 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-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors PIKFYVE, PI4KA, PIK3CA KMT2A 2175/4885RAB9A 713/4885NPC1 3855/4885

“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.