SCHEMBL29020697

SCHEMBL29020697

CC(C)(C)OC(=O)N1CCN(c2ccc(C(=O)N3CCCC3)nc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
TSHR P16473 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
GPR119 Q8TDV5 6/20 0.53
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
MGLL Q99685 1/20 0.48
CKS1B P61024 2/20 0.48
SKP1 P63208 2/20 0.48
SKP2 Q13309 2/20 0.48
POLB P06746 2/20 0.47
WNT3A P56704 1/20 0.46
NAMPT P43490 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
SCHEMBL30386022 1.00 MAPT (0.56) MAPTMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL30604693 0.87 MAPT (0.53) MAPTMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL29085204 0.87 MAPT (0.53) MAPTMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL14802434 0.86 MAPT (0.59) MAPTMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL18673194 0.86 MAPT (0.59) MAPTMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL25738496 0.85 SMN1; SMN2 (0.61) MAPTMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL25633952 0.85 MAPT (0.58) MAPTMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL27203577 0.85 MAPT (0.56) MAPTMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL29913781 0.84 SMN1; SMN2 (0.60) MAPTMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL14802410 0.84 SMN1; SMN2 (0.60) MAPTMEN1KMT2ATSHRSMN1; SMN2

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
CN-115919859-B Pharmaceutical composition of heteroaryl derivative and application of pharmaceutical composition in medicine 四川海思科制药有限公司 2024-01-05 CN disclosed
CN-115919859-A Pharmaceutical composition of heteroaryl derivative and application thereof in medicine 四川海思科制药有限公司 2023-04-07 CN disclosed