SCHEMBL27510285

SCHEMBL27510285

CCOC(=O)c1c(C)c(C(=O)OC)c(C)n1CC

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.68
MAPK1 P28482 4/20 0.68
TSHR P16473 4/20 0.61
RECQL P46063 1/20 0.60
TP53 P04637 1/20 0.58
KMT2A Q03164 1/20 0.57
ALDH1A1 P00352 6/20 0.56
LMNA P02545 3/20 0.56
MAPT P10636 2/20 0.56
NPSR1 Q6W5P4 1/20 0.56
CYP3A4 P08684 1/20 0.55
GLA P06280 1/20 0.54
ALOX15 P16050 1/20 0.53
GAA P10253 1/20 0.51
USP2 O75604 1/20 0.50

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
SCHEMBL10872915 0.85 HPGD (0.63) HPGDMAPK1TSHRRECQLTP53
SCHEMBL12926005 0.81 HPGD (0.57) HPGDMAPK1TSHRRECQLTP53
SCHEMBL24403122 0.77 KMT2A (0.61) HPGDMAPK1TSHRRECQLTP53
SCHEMBL11363402 0.73 KMT2A (1.00) HPGDTSHRKMT2AALDH1A1LMNA
Acetic Acid SCHEMBL11069409 0.72 KMT2A (0.50) HPGDMAPK1TSHRRECQLTP53
SCHEMBL11069408 0.72 KMT2A (0.50) HPGDMAPK1TSHRRECQLTP53
SCHEMBL5138552 0.71 KMT2A (0.67) HPGDMAPK1TSHRKMT2AALDH1A1
SCHEMBL24401824 0.69 KMT2A (0.50) HPGDMAPK1TSHRRECQLTP53
SCHEMBL15332147 0.69 USP2 (0.63) HPGDMAPK1TSHRRECQLTP53
SCHEMBL28375918 0.68 USP2 (0.50) HPGDMAPK1TSHRRECQLTP53

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-1257408-C Two-photon absorption dipyrromethene boron difluoride dye and application thereof ARCTIC DIAGNOSTICS OY (FI) 2006-05-24 CN disclosed
CN-1526071-A Two-photon absorption dipyrromethene boron difluoride dye and application thereof ����˹ҽ�����޹�˾ 2004-09-01 CN disclosed