SCHEMBL16631434

SCHEMBL16631434

Cc1c2cc(C)c(=O)nc-2[nH]c(F)c1C

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
TNKS O95271 2/20 0.32
TNKS2 Q9H2K2 2/20 0.32
PARP1 P09874 2/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
ATM Q13315 1/20 0.31
ERAP1 Q9NZ08 1/20 0.31
PARP2 Q9UGN5 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL16631436 0.88 NPC1 (0.30) NPC1RAB9AATMERAP1
SCHEMBL16631392 0.88 NPC1 (0.30) NPC1RAB9AATMERAP1
SCHEMBL18081812 0.83 NPC1 (0.33) PARP1NPC1RAB9AATMERAP1
SCHEMBL18081939 0.82 NPC1 (0.32) NPC1RAB9AATMERAP1KDM4E
SCHEMBL18081958 0.81 JAK1 (0.30) NPC1RAB9AATMERAP1
SCHEMBL18080458 0.81 PIM1 (0.33)
SCHEMBL16631714 0.79 MGAM (0.33) MGAMGAASIMGAM2
SCHEMBL18081917 0.79 PDE3B (0.35) TNKSTNKS2PARP2
SCHEMBL18081800 0.78 SLC9A1 (0.30) NPC1RAB9AATMERAP1
SCHEMBL18081781 0.77 FGFR1 (0.33) MGAMGAASIMGAM2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC. (US) 2016-09-15 US disclosed
WO-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 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-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF POLRMT, POLN, NSUN3 MGAM 2505/4885GAA 973/4885SI 4007/4885

“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.