SCHEMBL28994206

SCHEMBL28994206

Cc1ncc(COc2cc(F)cc(Oc3ccc(C(=O)O)cc3)c2)cn1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 5/20 0.51
▸ RXRA P19793 5/20 0.45
▸ RXRB P28702 5/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ NR4A1 P22736 1/20 0.45
▸ NR4A3 Q92570 1/20 0.45
▸ BTK Q06187 2/20 0.45
▸ PTGER4 P35408 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ MRGPRX4 Q96LA9 1/20 0.43
▸ PPARG P37231 2/20 0.42
▸ LDHA P00338 1/20 0.42
▸ SRD5A2 P31213 1/20 0.42

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
SCHEMBL30289685 1.00 NR4A2 (0.51) NR4A2RXRARXRBNPC1POLB
SCHEMBL28994247 0.89 BTK (0.44) NR4A2NPC1RAB9ABTKPPARG
SCHEMBL30289606 0.89 PARP10 (0.52) BTKKMT2A
SCHEMBL30289690 0.89 BTK (0.44) NR4A2NPC1RAB9ABTKPPARG
SCHEMBL28994191 0.88 MRGPRX4 (0.47) NPC1RAB9ASMN1; SMN2BTKMEN1
SCHEMBL16748844 0.83 BTK (0.47) BTK
SCHEMBL18900705 0.77 BTK (0.43) RAB9ABTKMEN1KMT2A
SCHEMBL16748845 0.75 DGAT1 (0.44) BTK
SCHEMBL15613577 0.75 CYP4F2 (0.40) BTKMRGPRX4
SCHEMBL2659482 0.74 KMT2A (0.73) NR4A2NR4A1NR4A3MEN1KMT2A

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-115894497-A Imidazopyrimidine compounds, and preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-04-04 — — CN disclosed
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