SCHEMBL753502

SCHEMBL753502

Cc1nc(-c2c(Cl)nc3ccccn23)c2ncn(C3CCCCO3)c2n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 1/20 0.47
CYP2C19 P33261 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP1A2 P05177 2/20 0.39
TSHR P16473 1/20 0.39
FLT3 P36888 4/20 0.37
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
KMT2A Q03164 2/20 0.36
TP53 P04637 1/20 0.36
CYP2C9 P11712 1/20 0.36
NFKB1 P19838 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
APEX1 P27695 1/20 0.36
PI4KA P42356 1/20 0.36
BLM P54132 1/20 0.36
ADCY1 Q08828 1/20 0.36

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
SCHEMBL112713 0.80 YTHDC1 (0.62) YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2
SCHEMBL115200 0.79 YTHDC1 (0.48) YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2
SCHEMBL13798746 0.74 YTHDC1 (0.59) YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2
SCHEMBL114675 0.74 YTHDC1 (0.50) YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2
SCHEMBL31186403 0.73 YTHDC1 (0.47) YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2
SCHEMBL114895 0.72 YTHDC1 (0.46) YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2
SCHEMBL29878036 0.72 YTHDC1 (0.46) YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2
SCHEMBL14296957 0.72 YTHDC1 (0.47) YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2
SCHEMBL21685707 0.71 YTHDC1 (0.56) YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2
SCHEMBL10121595 0.71 PI4KA (0.61) YTHDC1CYP2C19NPC1RAB9ASMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP disclosed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US disclosed
EP-2430013-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS Amgen, Inc (US) 2012-03-21 EP disclosed
WO-2010132598-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC. (US) 2010-11-18 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-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors PIK3CA, PIKFYVE, PIK3CD YTHDC1 4621/4885CYP2C19 1642/4885NPC1 732/4885

“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.