SCHEMBL27629398

SCHEMBL27629398

CNc1ccccc1C(=O)OC(C)CCC(C)C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.57
▸ POLB P06746 1/20 0.57
▸ ATM Q13315 1/20 0.57
▸ ADRA1A P35348 4/20 0.48
▸ ALDH1A1 P00352 6/20 0.47
▸ ADRA1D P25100 2/20 0.45
▸ ADRA1B P35368 2/20 0.45
▸ HPGD P15428 3/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ SCN1A P35498 1/20 0.42
▸ SCN2A Q99250 1/20 0.42
▸ SCN3A Q9NY46 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TSHR P16473 1/20 0.41
▸ GLA P06280 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HTT P42858 1/20 0.38

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
SCHEMBL3101890 0.85 KDM4E (0.60) KDM4EPOLBATMADRA1AALDH1A1
SCHEMBL4858499 0.81 KDM4E (0.58) KDM4EPOLBATMADRA1AALDH1A1
SCHEMBL28994536 0.80 ALDH1A1 (0.69) KDM4EALDH1A1HSD17B10SCN1ASCN2A
SCHEMBL28078429 0.79 ALDH1A1 (0.53) KDM4EPOLBALDH1A1HPGDHSD17B10
SCHEMBL4935052 0.78 KDM4E (0.64) KDM4EPOLBATMADRA1AALDH1A1
SCHEMBL1532488 0.77 ALDH1A1 (0.72) KDM4EPOLBATMADRA1AALDH1A1
SCHEMBL27673461 0.77 ALDH1A1 (0.49) KDM4EADRA1AALDH1A1LMNASCN1A
SCHEMBL28373886 0.76 ALDH1A1 (0.64) KDM4EALDH1A1SCN1ASCN2ASCN3A
2-Methylaminobenzoic Acid Methyl Ester SCHEMBL29364831 0.73 KDM4E (1.00) KDM4EPOLBATMALDH1A1HPGD
2-Methylaminobenzoic Acid Methyl Ester SCHEMBL165559 0.73 KDM4E (1.00) KDM4EPOLBATMALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1779568-B Hardenable resin composition, hardened body thereof, and printed wiring board TAIYO INK MFG CO LTD 2010-10-06 — — CN disclosed
CN-1779568-A Hardenable resin composition, hardened body thereof, and printed wiring board TAIYO INK MFG CO LTD (JP) 2006-05-31 — — CN disclosed
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