SCHEMBL19928684

SCHEMBL19928684

CCCCCC(/C=C1\SC(=O)NC1=O)CCCC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 11/20 0.42
▸ PIM2 Q9P1W9 10/20 0.42
▸ IGF1R P08069 1/20 0.42
▸ PTPN1 P18031 1/20 0.38
▸ HPGD P15428 4/20 0.38
▸ CISD1 Q9NZ45 1/20 0.37
▸ PIM3 Q86V86 1/20 0.36
▸ AKR1B1 P15121 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ GSK3B P49841 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ MAOA P21397 1/20 0.35
▸ MAOB P27338 1/20 0.35
▸ TTR P02766 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
SCHEMBL18711179 0.97 PIM1 (0.42) PIM1PIM2IGF1RPTPN1HPGD
SCHEMBL18711226 0.97 PIM1 (0.42) PIM1PIM2IGF1RPTPN1HPGD
SCHEMBL19928658 0.97 PIM1 (0.42) PIM1PIM2IGF1RPTPN1HPGD
SCHEMBL18711174 0.97 PIM1 (0.42) PIM1PIM2IGF1RPTPN1HPGD
SCHEMBL18711177 0.97 PIM1 (0.42) PIM1PIM2IGF1RPTPN1HPGD
SCHEMBL18711250 0.97 PIM1 (0.42) PIM1PIM2IGF1RPTPN1HPGD
SCHEMBL20355919 0.85 POLB (0.37) GSK3B
SCHEMBL20374334 0.84 POLB (0.36) HPGD
SCHEMBL20355916 0.82 HPGD (0.47) PIM1HPGDRAB9ANPC1TDP1
SCHEMBL20374327 0.80 HPGD (0.45) PIM1HPGDRAB9ANPC1TDP1

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-9908872-B2 Methods to treat lymphoplasmacytic lymphoma DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-03-06 — — US disclosed
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