SCHEMBL15080214

SCHEMBL15080214

CC(C)(C(=O)OCc1ccccc1)c1ccc(C(=O)C2CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ HTR2A P28223 2/20 0.43
▸ HTR2C P28335 1/20 0.43
▸ HTR2B P41595 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ GAA P10253 1/20 0.43
▸ TSHR P16473 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KCNH2 Q12809 2/20 0.41
▸ SLC6A2 P23975 1/20 0.41
▸ SLC6A3 Q01959 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ BCHE P06276 1/20 0.41
▸ MAPT P10636 1/20 0.40
▸ HPGD P15428 1/20 0.40

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
SCHEMBL228601 0.84 NR4A2 (0.51) KMT2AALDH1A1LMNASLC6A2SLC6A3
SCHEMBL18765453 0.82 HRH2 (0.44) KMT2AMEN1NPC1RAB9A
SCHEMBL15910890 0.81 LMNA (0.54) KMT2AALDH1A1LMNASMN1; SMN2SLC6A2
SCHEMBL23876186 0.78 NPC1 (0.49) KMT2AMEN1ALDH1A1LMNANPC1
SCHEMBL3045824 0.78 ALDH1A1 (0.49) KMT2AMEN1ALDH1A1TSHRSMN1; SMN2
SCHEMBL23876180 0.78 KMT2A (0.50) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL5732752 0.78 RAB9A (0.51) KMT2AMEN1ALDH1A1LMNANPC1
SCHEMBL13313606 0.77 MAOB (0.59) KMT2AMEN1ALDH1A1LMNANPC1
SCHEMBL12021937 0.76 HSD17B3 (0.49) ALDH1A1TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL1502290 0.76 MEN1 (0.51) KMT2AMEN1HTR2AHTR2CHTR2B

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-8476445-B2 Process for production of piperidine derivatives ALBANY MOLECULAR RESEARCH, INC. (US) 2013-07-02 — — US disclosed
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