SCHEMBL15624643

SCHEMBL15624643

Cc1ccc2nc3c(C)c(C)ccc3cc2c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 4/20 0.46
▸ PDE3A Q14432 4/20 0.46
▸ PDE2A O00408 1/20 0.46
▸ P2RY12 Q9H244 1/20 0.46
▸ MAOA P21397 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ TSHR P16473 2/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ CYP2A6 P11509 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ KDM1A O60341 7/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ CASP1 P29466 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
SCHEMBL862770 0.77 CYP1A2 (0.50) PDE3BPDE3APDE2AMAOAKDM4E
SCHEMBL15624706 0.75 PDE3B (0.49) PDE3BPDE3APDE2AP2RY12KDM4E
SCHEMBL862246 0.74 CYP1A2 (0.48) MAOAKDM4EMAPTMAPK1TSHR
SCHEMBL2773901 0.74 ALDH1A1 (0.52) PDE3BPDE3APDE2AP2RY12MAOA
SCHEMBL30164507 0.74 ALDH1A1 (0.52) PDE3BPDE3APDE2AP2RY12MAOA
SCHEMBL28364275 0.73 PARP1 (0.52) KDM4EALDH1A1
Bromide SCHEMBL17508351 0.73 ALDH1A1 (0.50) PDE3BPDE3APDE2AP2RY12MAOA
SCHEMBL29033070 0.73 ALDH1A1 (0.50) PDE3BPDE3APDE2AP2RY12MAOA
Iodide SCHEMBL3905318 0.73 ALDH1A1 (0.50) PDE3BPDE3APDE2AP2RY12MAOA
SCHEMBL15412757 0.73 CYP1A2 (0.56) PDE3BPDE3APDE2AP2RY12KDM4E

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
US-9396831-B2 Polymer compound and electronic device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-07-19 — — US disclosed
US-9396831-B2 Polymer compound and electronic device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-07-19 — — US disclosed
US-20140084217-A1 POLYMER COMPOUND AND ELECTRONIC DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-03-27 — — US disclosed
US-20140084217-A1 POLYMER COMPOUND AND ELECTRONIC DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-03-27 — — US disclosed
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