SCHEMBL4399013

SCHEMBL4399013

Cc1ccc2c(c1)nc(-c1ccncc1C)n2C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
POLB P06746 1/20 0.49
ATM Q13315 1/20 0.46
AGPAT2 O15120 1/20 0.44
PDE10A Q9Y233 7/20 0.42
PDE2A O00408 6/20 0.42
KDM4E B2RXH2 3/20 0.42
HSD17B10 Q99714 2/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NPC1 O15118 2/20 0.41
TP53 P04637 2/20 0.41
MAPT P10636 2/20 0.41
RAB9A P51151 2/20 0.41
CASP1 P29466 1/20 0.41
ACSS2 Q9NR19 1/20 0.41
PDE7A Q13946 2/20 0.40
RPS6KA5 O75582 1/20 0.40
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39

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
SCHEMBL10249024 0.86 SMN1; SMN2 (0.47) SMN1; SMN2POLBATMAGPAT2KDM4E
SCHEMBL10248939 0.86 AGPAT2 (0.50) SMN1; SMN2POLBATMAGPAT2PDE10A
SCHEMBL10249177 0.86 SMN1; SMN2 (0.47) SMN1; SMN2POLBATMAGPAT2KDM4E
SCHEMBL10248930 0.83 SMN1; SMN2 (0.45) SMN1; SMN2POLBATMAGPAT2PDE10A
SCHEMBL10249166 0.83 SMN1; SMN2 (0.61) SMN1; SMN2POLBATMAGPAT2PDE10A
SCHEMBL10248880 0.83 SMN1; SMN2 (0.45) SMN1; SMN2POLBATMAGPAT2PDE10A
SCHEMBL356013 0.82 PDE10A (0.58) SMN1; SMN2POLBATMAGPAT2PDE10A
SCHEMBL10249065 0.81 SMN1; SMN2 (0.43) SMN1; SMN2POLBATMAGPAT2PDE10A
SCHEMBL10248950 0.81 SMN1; SMN2 (0.43) SMN1; SMN2POLBATMAGPAT2PDE10A
SCHEMBL14699735 0.81 AGPAT2 (0.49) SMN1; SMN2POLBAGPAT2KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461181-B2 Fused heterocyclic compound and use thereof SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2013-06-11 US disclosed
US-8273764-B2 Fused heterocyclic compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-25 US disclosed
US-20120178779-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED 2012-07-12 US disclosed
WO-2012057265-A1 PEST CONTROL COMPOSITION AND METHOD FOR CONTROLLING PESTS 住友化学株式会社 (JP) 2012-05-03 WO disclosed
WO-2012057266-A1 PEST CONTROL COMPOSITION AND METHOD FOR CONTROLLING PESTS 住友化学株式会社 (JP) 2012-05-03 WO disclosed
WO-2012057268-A1 PEST CONTROL COMPOSITION AND METHOD FOR CONTROLLING PESTS 住友化学株式会社 (JP) 2012-05-03 WO disclosed
WO-2012057269-A1 HARMFUL ANIMAL CONTROL COMPOSITION AND METHOD FOR CONTROLLING HARMFUL ANIMALS 住友化学株式会社 (JP) 2012-05-03 WO disclosed
WO-2012057264-A1 PEST CONTROL COMPOSITION AND METHOD FOR CONTROLLING PESTS 住友化学株式会社 (JP) 2012-05-03 WO disclosed
WO-2012057273-A1 HARMFUL ANIMAL CONTROL COMPOSITION AND METHOD FOR CONTROLLING HARMFUL ANIMALS 住友化学株式会社 (JP) 2012-05-03 WO disclosed
WO-2012057260-A1 PEST CONTROL COMPOSITION AND METHOD FOR CONTROLLING PESTS 住友化学株式会社 (JP) 2012-05-03 WO disclosed
US-20120015975-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-19 US 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 (2 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-20120178779-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF C3AR1, C9, C5 SMN1; SMN2 1524/4885POLB 4724/4885ATM 4476/4885
US-20120015975-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF C3AR1, C9, C5 SMN1; SMN2 1524/4885POLB 4724/4885ATM 4476/4885

“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.