SCHEMBL19592645

SCHEMBL19592645

CCOC(=O)Cc1ccc2cc(C(=O)O)[nH]c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.51
▸ EIF4A3 P38919 1/20 0.49
▸ TBXAS1 P24557 1/20 0.48
▸ HRH3 Q9Y5N1 1/20 0.47
▸ KDM4E B2RXH2 6/20 0.46
▸ HPGD P15428 5/20 0.46
▸ ALDH1A1 P00352 5/20 0.46
▸ RAB9A P51151 4/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ NPC1 O15118 3/20 0.46
▸ MAPT P10636 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ GLA P06280 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ PIN1 Q13526 1/20 0.46
▸ HSD17B10 Q99714 4/20 0.45
▸ SRD5A2 P31213 3/20 0.45

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
SCHEMBL16729160 0.85 ALOX15 (0.52) ALOX15KDM4EHPGDALDH1A1RAB9A
SCHEMBL19592644 0.83 NPC1 (0.56) RAB9ASMN1; SMN2NPC1MAPTLMNA
SCHEMBL28660721 0.82 ALOX15 (0.62) ALOX15HRH3KDM4EHPGDALDH1A1
SCHEMBL1144575 0.81 DAO (0.58) ALOX15EIF4A3TBXAS1KDM4EHPGD
SCHEMBL7469548 0.80 KDM4E (0.42) ALOX15KDM4EALDH1A1RAB9ASMN1; SMN2
SCHEMBL17368519 0.77 ALOX15 (0.72) ALOX15HRH3KDM4EHPGDALDH1A1
SCHEMBL27987840 0.77 CA12 (0.50) ALOX15KDM4EHPGDALDH1A1RAB9A
SCHEMBL8251803 0.76 HRH3 (0.54) ALOX15TBXAS1HRH3KDM4EHPGD
SCHEMBL8985815 0.76 TBXAS1 (0.57) EIF4A3TBXAS1KDM4EHPGDALDH1A1
SCHEMBL10420380 0.76 NLRP3 (0.52) KDM4EHPGDALDH1A1RAB9ASMN1; SMN2

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
US-9815784-B2 CC-1065 analogs and their conjugates SYNTARGA B.V. (NL) 2017-11-14 — — US disclosed
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