SCHEMBL24328014

SCHEMBL24328014

O=C1C(Cl)=C(NCc2ccc(F)cc2)C(=O)c2c(O)ccc(O)c21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OXTR P30559 1/20 0.42
▸ AVPR1A P37288 1/20 0.42
▸ PPARA Q07869 1/20 0.41
▸ STING1 Q86WV6 1/20 0.41
▸ CISD1 Q9NZ45 1/20 0.40
▸ VNN1 O95497 2/20 0.39
▸ BRD4 O60885 1/20 0.39
▸ KAT2B Q92831 1/20 0.39
▸ RAB9A P51151 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ APAF1 O14727 1/20 0.36
▸ HK1 P19367 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HKDC1 Q2TB90 1/20 0.36

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
SCHEMBL24327928 0.85 HKDC1 (0.49) RAB9ALMNAKDM4EMAPTHTT
SCHEMBL24327534 0.85 FFAR1 (0.41) PPARAVNN1KDM4E
SCHEMBL24327531 0.82 MAPT (0.47) VNN1RAB9AMAPTHTTPOLB
SCHEMBL24327495 0.73 NSD2 (0.49) RAB9ALMNAKDM4EMAPTHTT
SCHEMBL14567006 0.72 RAB9A (0.49) CISD1RAB9ALMNAKDM4EMAPT
SCHEMBL24327529 0.72 MAPT (0.47) CISD1RAB9ALMNAKDM4EMAPT
SCHEMBL24327493 0.72 CDC25A (0.42) RAB9ALMNAKDM4EMAPTHTT
SCHEMBL24327930 0.71 MAPT (0.46) CISD1RAB9ALMNAKDM4EMAPT
SCHEMBL24327487 0.70 CDC25A (0.46) CISD1RAB9ALMNAKDM4EMAPT
SCHEMBL24327489 0.70 CDC25A (0.40) RAB9ALMNAKDM4EMAPTHTT

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
WO-2022081984-A1 METHODS AND COMPOUNDS TO TREAT SARS INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-04-21 — — WO disclosed
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