SCHEMBL4845577

SCHEMBL4845577

CNC(=O)OC(=O)N1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
POLB P06746 2/20 0.39
HPGD P15428 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
GAA P10253 2/20 0.35
HSD11B1 P28845 1/20 0.35
MAPT P10636 2/20 0.35
HTT P42858 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
TSHR P16473 1/20 0.35
CHRM1 P11229 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL3946457 0.98 ALDH1A1 (0.42) ALDH1A1POLBHPGDSMN1; SMN2GAA
SCHEMBL23854195 0.96 POLB (0.39) ALDH1A1POLBHPGDSMN1; SMN2GAA
SCHEMBL17560355 0.82 CHRNB2 (0.42) POLBHPGDHSD11B1
SCHEMBL18399277 0.82 TSHR (0.52) ALDH1A1POLBSMN1; SMN2HTTTSHR
SCHEMBL28943426 0.79 SMN1; SMN2 (0.40) ALDH1A1POLBHPGDSMN1; SMN2GAA
SCHEMBL21066382 0.78 ALDH1A1 (0.39) ALDH1A1POLBHPGDSMN1; SMN2GAA
SCHEMBL4725324 0.77 ALDH1A1 (0.42) ALDH1A1POLBHPGDSMN1; SMN2GAA
SCHEMBL3885999 0.76 EPHX1 (0.44) ALDH1A1POLBHPGDHTTCHRM1
SCHEMBL30443406 0.76 ALDH1A1 (0.54) ALDH1A1POLBHPGDSMN1; SMN2GAA
SCHEMBL28195034 0.75 ALDH1A1 (0.43) ALDH1A1POLBHPGDSMN1; SMN2GAA

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-4346898-A1 METHODS FOR INHIBITING RAS Revolution Medicines, Inc. (US) 2024-04-10 EP disclosed
WO-2023208005-A1 CYCLIC COMPOUNDS, PREPARATION METHODS AND MEDICINAL USES THEREOF HANSOH BIO LLC (US) 2023-11-02 WO disclosed
WO-2022251292-A1 METHODS FOR INHIBITING RAS Revolution Medicines, Inc. (US) 2022-12-01 WO disclosed
EP-3071564-A1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS Sunshine Lake Pharma Co., Ltd. (CN) 2016-09-28 EP disclosed
CN-103502240-B Azole derivatives 大正制药株式会社 2016-08-31 CN disclosed
CN-103068830-B Arginase inhibitors and therapeutic uses thereof 马尔斯公司 2016-06-29 CN disclosed
WO-2015074546-A1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-05-28 WO disclosed
WO-2008011130-A2 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-24 WO disclosed