SCHEMBL27705246

SCHEMBL27705246

CCCC(N)CNc1nc(N2CCN(c3ccccc3)CC2)nc2c1SCC2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE11A Q9HCR9 3/20 0.38
▸ MAPT P10636 4/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ PDE2A O00408 2/20 0.37
▸ PDE4A P27815 1/20 0.37
▸ PDE6C P51160 1/20 0.37
▸ PDE10A Q9Y233 1/20 0.37
▸ PDE1B Q01064 1/20 0.37
▸ HTT P42858 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ USP2 O75604 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ ALOX12 P18054 1/20 0.35

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
SCHEMBL2916952 0.85 PDE11A (0.42) PDE11AMAPTALDH1A1KMT2AHSD17B10
SCHEMBL3026830 0.77 PDE11A (0.43) PDE11AMAPTALDH1A1KMT2AHSD17B10
SCHEMBL2918449 0.76 HTR2C (0.47) MAPTALDH1A1KMT2AHSD17B10MEN1
SCHEMBL3948726 0.75 CETP (0.45) ALDH1A1KMT2AMEN1TSHRGAA
SCHEMBL2922786 0.75 HTT (0.36) PDE11AMAPTALDH1A1KMT2AHSD17B10
SCHEMBL2920928 0.75 ESR1 (0.36) PDE11AMAPTALDH1A1KMT2AHSD17B10
SCHEMBL2911656 0.75 MEN1 (0.34) PDE11AMAPTALDH1A1KMT2AHSD17B10
SCHEMBL13212462 0.74 PDE11A (0.37) PDE11AMAPTALDH1A1KMT2AHSD17B10
SCHEMBL2923250 0.73 KMT2A (0.41) PDE11AMAPTALDH1A1KMT2AHSD17B10
SCHEMBL3027474 0.73 CHRNA10 (0.37) PDE11AALDH1A1KMT2AMEN1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101163706-A Dihydrothienopyrimidines for the treatment of inflammatory diseases BOEHRINGER INGELHEIM INT (DE) 2008-04-16 — — CN disclosed
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