SCHEMBL29336962

SCHEMBL29336962

O=C(COCCOCCOCC(=O)ON1C(=O)CCC1=O)NCC1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ ALDH1A1 P00352 5/20 0.40
▸ MAPT P10636 2/20 0.40
▸ PTBP1 P26599 1/20 0.40
▸ POLB P06746 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ LMNA P02545 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ EPHX1 P07099 1/20 0.38
▸ RAB9A P51151 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ MITF O75030 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ MDM2 Q00987 1/20 0.36
▸ NAAA Q02083 1/20 0.35

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
SCHEMBL29336966 0.90 ALDH1A1 (0.41) HPGDKMT2AMEN1ALDH1A1MAPT
SCHEMBL29335333 0.79 SMN1; SMN2 (0.41) HPGDKMT2AMEN1ALDH1A1MAPT
SCHEMBL24621700 0.79 ADORA3 (0.33) —
SCHEMBL17167184 0.79 ADORA3 (0.33) —
SCHEMBL12743131 0.77 ADORA3 (0.33) —
SCHEMBL9002622 0.76 EPHX1 (0.45) KMT2AEPHX1RAB9ANPC1
SCHEMBL12981918 0.76 HPGD (0.36) HPGDKMT2AMEN1ALDH1A1LMNA
SCHEMBL13226861 0.76 HPGD (0.36) HPGDKMT2AMEN1SMN1; SMN2HTT
SCHEMBL12981636 0.76 HPGD (0.46) HPGDKMT2AMEN1ALDH1A1KDM4E
SCHEMBL29336904 0.75 KDM4E (0.50) HPGDKMT2AMEN1ALDH1A1MAPT

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
WO-2024150132-A1 LIGAND-DRUG CONJUGATES SUN PHARMA ADVANCED RESEARCH COMPANY LIMITED (IN) 2024-07-18 — — WO disclosed
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