SCHEMBL9685405

SCHEMBL9685405

CCOC(=O)c1cc2nc(N3CCN(Cc4ccccc4)CC3)ncc2c(=O)n1CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.46
ALDH1A1 P00352 13/20 0.44
SMN1; SMN2 Q16637 5/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
TSHR P16473 6/20 0.43
KDM4E B2RXH2 4/20 0.43
HTT P42858 3/20 0.43
LMNA P02545 3/20 0.43
POLB P06746 2/20 0.43
ALOX15 P16050 1/20 0.43
HPGD P15428 5/20 0.42
CASP1 P29466 4/20 0.42
CASP7 P55210 4/20 0.42
MAPT P10636 3/20 0.42
USP2 O75604 3/20 0.42
HIF1A Q16665 2/20 0.42
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GLA P06280 1/20 0.42

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
SCHEMBL9686157 0.78 NPSR1 (0.55) PRMT1ALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL11583159 0.77 LMNA (0.59) ALDH1A1KMT2AMEN1TSHRKDM4E
SCHEMBL9684556 0.76 LMNA (0.51) ALDH1A1SMN1; SMN2KMT2AMEN1TSHR
SCHEMBL1618023 0.76 PRMT1 (0.61) PRMT1ALDH1A1TSHRLMNAMAPK1
SCHEMBL9684629 0.75 PRMT1 (0.51) PRMT1ALDH1A1SMN1; SMN2TSHRHTT
SCHEMBL9298122 0.75 PRMT1 (0.51) PRMT1ALDH1A1SMN1; SMN2TSHRHTT
SCHEMBL9685436 0.75 PRMT1 (0.51) PRMT1ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL9685366 0.75 PTPN11 (0.59) PRMT1ALDH1A1SMN1; SMN2TSHRLMNA
SCHEMBL11870333 0.74 TRPA1 (0.46) PRMT1ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL8812552 0.74 ALOX15 (0.51) PRMT1ALDH1A1SMN1; SMN2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-61060687-A None JP disclosed
EP-0188094-B1 QUINAZOLINE DERIVATIVES AND ANTIHYPERTENSIVE PREPARATIONS CONTAINING SAME AS EFFECTIVE COMPONENTS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-03-18 EP disclosed
US-4734418-A Quinazoline compounds and antihypertensives MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1988-03-29 US disclosed
EP-0188094-A2 Quinazoline derivatives and antihypertensive preparations containing same as effective components MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1986-07-23 EP disclosed
JP-S6160687-A PYRIDOPYRIMIDINE DERIVATIVE AND ITS PRODUCTION MITSUI PETROCHEM IND LTD 1986-03-28 JP disclosed