Oxazole

Oxazole

SCHEMBL28485458

CCC(C)c1cc(C(C)(C)C)cc(-n2nc3ccccc3n2)c1O.c1cocn1

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
TSHR P16473 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
RORC P51449 1/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
KDM4E B2RXH2 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
SCHEMBL78803 0.89 NPC1 (0.45) NPC1RAB9ATSHRCYP1A2CYP3A4
SCHEMBL29463599 0.89 NPC1 (0.45) NPC1RAB9ATSHRCYP1A2CYP3A4
SCHEMBL5804791 0.82 NPC1 (0.43) NPC1RAB9ATSHRCYP1A2CYP3A4
SCHEMBL3191876 0.80 RORC (0.44) NPC1RAB9ATSHRCYP1A2CYP3A4
SCHEMBL708739 0.79 RORC (0.40) NPC1RAB9ATSHRCYP1A2CYP3A4
SCHEMBL5447098 0.77 RORC (0.39) NPC1RAB9ATSHRCYP1A2CYP3A4
SCHEMBL9468591 0.77 NPC1 (0.46) NPC1RAB9ATSHRCYP1A2CYP3A4
SCHEMBL31252554 0.77 NPC1 (0.40) NPC1RAB9ATSHRCYP1A2CYP3A4
SCHEMBL20394044 0.77 NPC1 (0.40) NPC1RAB9ATSHRCYP1A2CYP3A4
SCHEMBL713026 0.76 RORC (0.40) NPC1RAB9ATSHRCYP1A2CYP3A4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110461377-B Composition for hard tissue repair and kit for hard tissue repair 三井化学株式会社 2022-05-10 CN disclosed
CN-111867640-B Composition for hard tissue repair and kit for hard tissue repair 三井化学株式会社 2022-04-08 CN disclosed
CN-111867640-A Composition for hard tissue repair and kit for hard tissue repair 三井化学株式会社 2020-10-30 CN disclosed