SCHEMBL8610002

SCHEMBL8610002

CCCCCNc1cc2c(=O)c3ccccc3[nH]c2c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.50
▸ UTS2R Q9UKP6 3/20 0.44
▸ MMP2 P08253 2/20 0.43
▸ MMP9 P14780 1/20 0.43
▸ MMP8 P22894 1/20 0.43
▸ MMP13 P45452 1/20 0.43
▸ PARP14 Q460N5 5/20 0.42
▸ ABCB1 P08183 1/20 0.41
▸ APAF1 O14727 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ TSHR P16473 2/20 0.41
▸ LMNA P02545 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ CTSV O60911 1/20 0.39
▸ CTSL P07711 1/20 0.39
▸ KCNA3 P22001 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 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
SCHEMBL14030957 0.83 PARP14 (0.53) MAOAPARP14ALDH1A1LMNAHSD17B10
SCHEMBL14088099 0.81 MAOA (0.55) MAOAPARP14ABCB1ALDH1A1LMNA
SCHEMBL30097103 0.75 MEN1 (0.58) APAF1ALDH1A1LMNASMN1; SMN2USP2
SCHEMBL439386 0.75 MEN1 (0.58) APAF1ALDH1A1LMNASMN1; SMN2USP2
SCHEMBL14355332 0.75 MAOA (0.61) MAOAPARP14ABCB1ALDH1A1LMNA
SCHEMBL14031020 0.75 PARP14 (0.58) MAOAPARP14TSHRCYP1A2
SCHEMBL14088097 0.74 P2RY12 (0.48) MAOAPARP14ALDH1A1
SCHEMBL14355331 0.74 MAOA (0.60) MAOAABCB1ALDH1A1TSHRLMNA
SCHEMBL11119733 0.74 MEN1 (0.56) APAF1ALDH1A1LMNASMN1; SMN2KCNA3
SCHEMBL7855739 0.74 MEN1 (0.56) APAF1ALDH1A1LMNASMN1; SMN2KCNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996041144-A2 POLYOXYHYDROCARBYL MARKER PRODUCTS AND METHODS FOR FLUORESCENCE ASSAYS HYPERION, INC. (US) 1996-12-19 — — WO claimed
US-5880287-A FLUORESCENT DYES FREE OF AGGREGATION AND SERUM BINDING HYPERION, INC. (US) 1999-03-09 — — US disclosed
WO-1996041144-A2 POLYOXYHYDROCARBYL MARKER PRODUCTS AND METHODS FOR FLUORESCENCE ASSAYS HYPERION, INC. (US) 1996-12-19 — — WO disclosed
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