SCHEMBL8880355

SCHEMBL8880355

[CH2]CCCC(=O)OCCCCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.62
FFAR1 O14842 2/20 0.54
LMNA P02545 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPT P10636 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
NPC1 O15118 2/20 0.48
RECQL P46063 1/20 0.48
RAB9A P51151 1/20 0.48
HDAC3 O15379 1/20 0.47
MAPK1 P28482 1/20 0.47
ADRA1A P35348 1/20 0.47
HDAC4 P56524 1/20 0.47
SLC6A3 Q01959 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47

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
SCHEMBL8894613 0.98 TDP1 (0.60) TDP1FFAR1LMNASMN1; SMN2ALDH1A1
SCHEMBL8894584 0.95 TDP1 (0.64) TDP1FFAR1LMNASMN1; SMN2ALDH1A1
SCHEMBL8880920 0.94 TDP1 (0.58) TDP1FFAR1LMNASMN1; SMN2ALDH1A1
SCHEMBL8896264 0.94 TDP1 (0.58) TDP1FFAR1LMNASMN1; SMN2ALDH1A1
SCHEMBL8878852 0.94 TDP1 (0.58) TDP1FFAR1LMNASMN1; SMN2ALDH1A1
SCHEMBL8895952 0.94 TDP1 (0.58) TDP1FFAR1LMNASMN1; SMN2ALDH1A1
SCHEMBL8894015 0.90 TDP1 (0.66) TDP1FFAR1LMNASMN1; SMN2ALDH1A1
SCHEMBL19643833 0.90 TDP1 (0.70) TDP1FFAR1LMNASMN1; SMN2ALDH1A1
SCHEMBL8896110 0.89 TDP1 (0.60) TDP1FFAR1LMNASMN1; SMN2ALDH1A1
SCHEMBL7781081 0.89 TDP1 (0.68) TDP1FFAR1LMNASMN1; SMN2ALDH1A1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691341-A ANTILEUKEMIA AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-11-25 US disclosed
US-5670563-A ORGANOTIN COMPOUND, PHOSPHORUS COMPOUND CIBA-SPECIALTY CHEMICALS CORPORATION (US) 1997-09-23 US disclosed
US-5639770-A SUPEROXIDE INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-06-17 US disclosed
US-5464833-A Anticarcinogenic agents, antiretrovirus agents or autoimmune diseases OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-11-07 US disclosed
EP-0623598-A1 APOPTOSIS REGULATOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-11-09 EP disclosed
US-5358949-A Carbostyril derivatives and salts thereof and anti-arrhythmic agents containing the carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-10-25 US disclosed
EP-0600092-A1 THIAZOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-08 EP disclosed
EP-0236140-A2 Carbostyril derivatives and salts thereof and anti-arrhythmic agents containing the carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-09-09 EP disclosed