SCHEMBL3487078

SCHEMBL3487078

CNc1nc(Oc2ccc(C)cc2)ccc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
MAP4K4 O95819 2/20 0.48
TEAD4 Q15561 1/20 0.43
ALDH1A1 P00352 2/20 0.42
MAPT P10636 2/20 0.42
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
F2 P00734 1/20 0.40
F10 P00742 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
ST14 Q9Y5Y6 1/20 0.40
NPC1 O15118 4/20 0.40
RAB9A P51151 3/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
ATM Q13315 1/20 0.40
KDM4E B2RXH2 1/20 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
SCHEMBL3488415 0.86 ALDH1A1 (0.43) MEN1KMT2AMAP4K4ALDH1A1MAPT
SCHEMBL2944371 0.85 NUDT1 (0.53) MEN1KMT2AMAP4K4ALDH1A1MAPT
SCHEMBL3487123 0.83 KMT2A (0.44) MEN1KMT2AMAP4K4ALDH1A1MAPT
SCHEMBL3487024 0.80 MAP4K4 (0.42) MEN1KMT2AMAP4K4MAPTPOLB
SCHEMBL95212 0.75 SIRT2 (0.41) KMT2AALDH1A1POLBTDP1NPC1
SCHEMBL29378197 0.75 SIRT2 (0.41) KMT2AALDH1A1POLBTDP1NPC1
SCHEMBL3487431 0.75 MEN1 (0.44) MEN1KMT2AMAP4K4ALDH1A1MAPT
Hydrochloric Acid SCHEMBL3391003 0.74 SIRT2 (0.40) KMT2AALDH1A1POLBTDP1NPC1
Hydrochloric Acid SCHEMBL4602018 0.74 SIRT2 (0.40) KMT2AALDH1A1POLBTDP1NPC1
Hydrochloric Acid SCHEMBL31409347 0.74 SIRT2 (0.40) KMT2AALDH1A1POLBTDP1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2138484-B1 FUSED BICYCLIC HETEROARYL DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2015-08-26 EP disclosed
CN-101679298-B Fused bicyclic heteroaryl derivatives DAIICHI SANKYO CO LTD 2013-10-23 CN disclosed
US-20130035337-A1 FUSED BICYCLIC HETEROARYL DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-02-07 US disclosed
CN-101679298-A fused bicyclic heteroaryl derivatives DAIICHI SANKYO CO LTD 2010-03-24 CN disclosed
US-20100048564-A1 FUSED BICYCLIC HETEROARYL DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-02-25 US disclosed
EP-2138484-A1 FUSED BICYCLIC HETEROARYL DERIVATIVES Daiichi Sankyo Company, Limited (JP) 2009-12-30 EP 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-20130035337-A1 FUSED BICYCLIC HETEROARYL DERIVATIVE PPARG, GPR119, PPARA MEN1 4545/4885KMT2A 2465/4885MAP4K4 2382/4885
US-20100048564-A1 FUSED BICYCLIC HETEROARYL DERIVATIVE PPARG, GPR119, PPARA MEN1 4545/4885KMT2A 2465/4885MAP4K4 2382/4885

“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.