SCHEMBL7488907

SCHEMBL7488907

O=C(Cl)NN1CCc2ccccc2C1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 7/20 0.61
NOTUM Q6P988 1/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPT P10636 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 2/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
HDAC3 O15379 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
NCOR2 Q9Y618 1/20 0.44
MAOA P21397 2/20 0.44

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
SCHEMBL7479368 0.84 LIPE (0.68) LIPENOTUMMEN1KMT2AMAPT
SCHEMBL7456919 0.83 LIPE (0.61) LIPENOTUMMEN1KMT2AMAPT
SCHEMBL11881512 0.83 LIPE (0.61) LIPENOTUMMEN1KMT2AMAPT
SCHEMBL14890641 0.80 LIPE (0.62) LIPEKMT2AMAPTNPC1TP53
SCHEMBL14907228 0.79 LIPE (0.66) LIPEMEN1KMT2ASMN1; SMN2GAA
SCHEMBL9109432 0.78 SMN1; SMN2 (0.60) LIPEMEN1KMT2AMAPTNPC1
SCHEMBL7549708 0.76 LIPE (1.00) LIPENOTUMNPC1TP53RAB9A
SCHEMBL5672647 0.76 LIPE (0.55) LIPENOTUMMEN1KMT2AMAPT
SCHEMBL14907137 0.75 LIPE (0.55) LIPEMEN1KMT2AMAPTNPC1
SCHEMBL11269986 0.75 KEAP1 (0.59) LIPEKMT2AMAPTSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0950056-B1 N-(PYRIDINYLAMINO)ISOINDOLINES AND RELATED COMPOUNDS AVENTIS PHARMA INC (US) 2002-09-18 EP disclosed
US-6004977-A ANTIDEPRESSANTS, COGNITION ACTIVATORS, AND ALZHEIMER'S DISEASE TREATMENT HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US disclosed