SCHEMBL14068947

SCHEMBL14068947

CCC(C)(C)c1ccc(OC(=O)[C@H]2CC[C@H](C(=O)Oc3ccc(C(C)(C)CC)cc3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.54
▸ HTT P42858 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ RECQL P46063 1/20 0.50
▸ ELANE P08246 1/20 0.49
▸ ATM Q13315 1/20 0.46
▸ HRH3 Q9Y5N1 8/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ MAPT P10636 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ MAOB P27338 2/20 0.43
▸ F2 P00734 1/20 0.43

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
SCHEMBL13681381 0.87 NPC1 (0.45) TDP1HTTKMT2ASMN1; SMN2RECQL
SCHEMBL14665322 0.86 TDP1 (0.43) TDP1HTTKMT2ASMN1; SMN2RECQL
SCHEMBL27513840 0.83 SMN1; SMN2 (0.61) TDP1HTTKMT2ASMN1; SMN2ELANE
SCHEMBL17059535 0.82 ADORA3 (0.48) TDP1HTTKMT2ASMN1; SMN2RECQL
SCHEMBL12755550 0.81 ADORA3 (0.47) TDP1HTTKMT2ASMN1; SMN2RECQL
SCHEMBL1790593 0.80 KMT2A (0.56) TDP1HTTKMT2ASMN1; SMN2RECQL
SCHEMBL1952350 0.80 TDP1 (0.54) TDP1KMT2AELANEHRH3NPC1
SCHEMBL15445453 0.79 TDP1 (0.41) TDP1RECQLHRH3NPC1RAB9A
SCHEMBL11823665 0.79 KMT2A (0.83) TDP1HTTKMT2ASMN1; SMN2ELANE
SCHEMBL1787793 0.78 TDP1 (0.52) TDP1KMT2AELANEHRH3NPC1

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
US-20080213507-A1 POLYMER FILM, PROCESS FOR PRODUCING THE SAME, AND POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY USING THE SAME FUJIFILM CORPORATION (JP) 2008-09-04 — — US disclosed
US-20080213507-A1 POLYMER FILM, PROCESS FOR PRODUCING THE SAME, AND POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY USING THE SAME FUJIFILM CORPORATION (JP) 2008-09-04 — — US disclosed
Send feedback