SCHEMBL16631550

SCHEMBL16631550

Cc1cc(F)c2cc(C)c(=O)nc-2[nH]1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 1/20 0.35
MAPT P10636 1/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
P2RX7 Q99572 3/20 0.33
PKM P14618 2/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
KMT2A Q03164 2/20 0.32
CA1 P00915 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
ATM Q13315 1/20 0.31
ERAP1 Q9NZ08 1/20 0.31
HPGD P15428 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HSD17B10 Q99714 1/20 0.31
KEAP1 Q14145 1/20 0.31

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
SCHEMBL16631385 0.86 AMY1A (0.35) AMY1AMGAMGAASIMGAM2
SCHEMBL16631413 0.85 MAPT (0.35) MAPTGAAADORA2AADORA1KMT2A
SCHEMBL16631716 0.81 KDM4E (0.36) AMY1AMAPTMGAMGAASI
SCHEMBL18081918 0.80 NOTUM (0.35) AMY1AKMT2AHPGDKDM4EHSD17B10
SCHEMBL18080466 0.80 TRPV1 (0.35) AMY1AMAPTP2RX7PKMADORA2A
SCHEMBL18081781 0.79 FGFR1 (0.33) AMY1AMGAMGAASIMGAM2
SCHEMBL18081812 0.77 NPC1 (0.33) NPC1RAB9AATMERAP1HPGD
SCHEMBL18081954 0.77 NPC1 (0.33) NPC1RAB9AATMERAP1HPGD
SCHEMBL16631434 0.77 MGAM (0.33) MGAMGAASIMGAM2NPC1
SCHEMBL18081800 0.76 SLC9A1 (0.30) NPC1RAB9AATMERAP1

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 AMY1A 4019/4885MAPT 3290/4885MGAM 2505/4885

“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.