SCHEMBL8268180

SCHEMBL8268180

COC(=O)Cn1c(Cl)nc2ccccc21

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.67
ALDH1A1 P00352 3/20 0.67
HSD17B10 Q99714 3/20 0.64
NPC1 O15118 1/20 0.64
LMNA P02545 2/20 0.61
MAPT P10636 3/20 0.60
KMT2A Q03164 2/20 0.58
SMN1; SMN2 Q16637 1/20 0.56
AR P10275 1/20 0.52
MEN1 O00255 1/20 0.50
DRD2 P14416 2/20 0.49
TBXA2R P21731 2/20 0.49
HPGD P15428 1/20 0.49
HTT P42858 1/20 0.49
TSHR P16473 1/20 0.49

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
SCHEMBL6829039 0.86 KDM4E (0.53) KDM4EALDH1A1HSD17B10NPC1LMNA
SCHEMBL569988 0.86 KDM4E (0.70) KDM4EALDH1A1HSD17B10LMNAMAPT
SCHEMBL6506620 0.85 KDM4E (0.52) KDM4EALDH1A1HSD17B10NPC1LMNA
SCHEMBL12495433 0.84 ALDH1A1 (0.72) KDM4EALDH1A1HSD17B10NPC1LMNA
SCHEMBL5121884 0.82 KDM4E (0.67) KDM4EALDH1A1HSD17B10NPC1LMNA
SCHEMBL15643239 0.82 TSPO (0.58) KDM4EALDH1A1HSD17B10NPC1LMNA
SCHEMBL4288066 0.81 KDM4E (0.65) KDM4EALDH1A1HSD17B10LMNAKMT2A
SCHEMBL3580770 0.81 KDM4E (0.65) KDM4EALDH1A1HSD17B10NPC1LMNA
SCHEMBL15643536 0.81 MAPT (0.65) KDM4EALDH1A1HSD17B10NPC1LMNA
SCHEMBL17824310 0.80 LMNA (0.53) KDM4EALDH1A1LMNAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090280106-A1 Pituitary adenylate cyclase acivating peptide (pacap) receptor (vpac2) agonists and their pharmacological methods of use BAYER PHARMACEUTICALS CORPORATION (US) 2009-11-12 US disclosed
US-20090280106-A1 Pituitary adenylate cyclase acivating peptide (pacap) receptor (vpac2) agonists and their pharmacological methods of use BAYER PHARMACEUTICALS CORPORATION (US) 2009-11-12 US disclosed
WO-2006049681-A2 SELECTIVE NEUROPEPTIDE Y2 RECEPTOR AGONISTS BAYER PHARMACEUTICALS CORPORATION (US) 2006-05-11 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-20090280106-A1 Pituitary adenylate cyclase acivating peptide (pacap) receptor (vpac2) agonists and their pharmacological methods of use ADCYAP1R1, VIPR2, ADCY2 KDM4E 2974/4885ALDH1A1 2368/4885HSD17B10 1838/4885

“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.