SCHEMBL9503176

SCHEMBL9503176

O=C(CCC(=O)c1ccccc1)NN1CCOCC1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
KMT2A Q03164 3/20 0.61
MAPT P10636 2/20 0.61
HSD17B10 Q99714 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
NR4A2 P43354 1/20 0.47
LMNA P02545 2/20 0.47
CYP2C19 P33261 1/20 0.47
CYP2D6 P10635 1/20 0.47
CTNNB1 P35222 1/20 0.46

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
SCHEMBL11660114 0.91 KMT2A (0.58) ALDH1A1KMT2AMAPTHSD17B10LMNA
SCHEMBL9506397 0.82 MMP1 (0.59) ALDH1A1KMT2AMAPTHSD17B10LMNA
SCHEMBL3955220 0.79 SMN1; SMN2 (0.71) ALDH1A1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL265358 0.79 GLA (0.48) ALDH1A1HSD17B10SMN1; SMN2LMNACYP2C19
SCHEMBL6790329 0.78 SMN1; SMN2 (0.59) ALDH1A1KMT2AMAPTSMN1; SMN2NPC1
SCHEMBL321369 0.76 ALDH1A1 (1.00) ALDH1A1KMT2AMAPTLMNACYP2C19
SCHEMBL7445195 0.76 LIPE (0.63) ALDH1A1KMT2AMAPTHSD17B10
SCHEMBL7416174 0.75 SMN1; SMN2 (0.52) ALDH1A1KMT2AMAPTSMN1; SMN2NPC1
SCHEMBL9506312 0.74 HDAC8 (0.56) ALDH1A1KMT2AMAPTHSD17B10LMNA
SCHEMBL501352 0.74 ALDH1A1 (0.82) ALDH1A1KMT2AMAPTSMN1; SMN2NPC1

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
EP-0300325-B1 COMPOSITIONS FOR PROMOTING GROWTH OF ANIMALS COMETEC S.r.l. (IT) 1993-06-16 EP claimed
US-4950669-A SIDE EFFECT REDUCTION COMETEC S.R.L. (IT) 1990-08-21 US claimed
US-4115570-A CENTRAL NERVOUS SYSTEM DEPRESSANTS ISTITUTO CHEMIOTERAPICO ITALIANO, S.P.A. (IT) 1978-09-19 US claimed
JP-1063546-A None JP disclosed
EP-0300325-B1 COMPOSITIONS FOR PROMOTING GROWTH OF ANIMALS COMETEC S.r.l. (IT) 1993-06-16 EP disclosed
US-4950669-A SIDE EFFECT REDUCTION COMETEC S.R.L. (IT) 1990-08-21 US disclosed
EP-0300325-A2 Compositions for promoting growth of animals COMETEC S.r.l. (IT) 1989-01-25 EP disclosed
US-4115570-A CENTRAL NERVOUS SYSTEM DEPRESSANTS ISTITUTO CHEMIOTERAPICO ITALIANO, S.P.A. (IT) 1978-09-19 US disclosed