SCHEMBL29057635

SCHEMBL29057635

CCN1CCN(CCCC(C)(C)NC(=O)O)CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 4/20 0.40
PKM P14618 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.36
USP2 O75604 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HSD11B1 P28845 1/20 0.36
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
POLB P06746 1/20 0.35
ACHE P22303 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
SCHEMBL29057665 0.84 CHRM5 (0.43) MEN1KMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL15183482 0.73 KDM1A (0.38) ALDH1A1KDM4EMAPK1
SCHEMBL27312162 0.73 ALDH1A1 (0.50) MEN1KMT2AALDH1A1TDP1MAPT
SCHEMBL21946781 0.72 SMN1; SMN2 (0.55) MEN1KMT2AALDH1A1PKMSMN1; SMN2
SCHEMBL3126033 0.71 MEN1 (0.34) MEN1KMT2A
SCHEMBL20076261 0.70 KDM1A (0.36) ALDH1A1KDM4EMAPK1
SCHEMBL29138679 0.70 ALDH1A1 (0.47) MEN1KMT2AALDH1A1TDP1MAPT
SCHEMBL25319811 0.69 CYP4F2 (0.41) MEN1KMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL6729367 0.68 ALDH1A1 (0.59) MEN1KMT2AALDH1A1KDM4EPKM
SCHEMBL10226086 0.67 GNAI3 (0.39) ALDH1A1KDM4EMAPK1

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
CN-116438182-A 7-azaindole compounds for inhibiting BCR-ABL tyrosine kinase 活力疗法公司 2023-07-14 CN disclosed