SCHEMBL8799382

SCHEMBL8799382

Cc1oc2c(NC(=O)c3c(Cl)cncc3Cl)cccc2c1C(C)(C)O

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 2/20 0.37
JAK2 O60674 1/20 0.37
CYP3A4 P08684 1/20 0.37
JAK1 P23458 1/20 0.37
RAB9A P51151 1/20 0.36
ALDH1A1 P00352 2/20 0.36
TP53 P04637 1/20 0.36
THRB P10828 1/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PTGES O14684 1/20 0.36
PDE4B Q07343 1/20 0.36
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GPR35 Q9HC97 2/20 0.35
GHSR Q92847 3/20 0.35
PTGS2 P35354 1/20 0.35

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
SCHEMBL7824213 0.91 RAB9A (0.41) TYK2JAK2CYP3A4JAK1RAB9A
SCHEMBL7827083 0.86 TYK2 (0.47) TYK2RAB9AALDH1A1LMNAMAPT
SCHEMBL7816537 0.84 GPR35 (0.41) TYK2JAK2JAK1RAB9AALDH1A1
SCHEMBL7825378 0.82 GAA (0.42) CYP3A4ALDH1A1LMNAMAPTNPSR1
SCHEMBL8345841 0.81 GPR35 (0.39) ALDH1A1LMNAMAPTNPSR1KMT2A
SCHEMBL8345039 0.81 PDE4D (0.41) RAB9AALDH1A1LMNAMAPTNPSR1
SCHEMBL7825606 0.80 GPR35 (0.43) TYK2JAK2CYP3A4JAK1RAB9A
SCHEMBL7817437 0.79 ALDH1A1 (0.39) ALDH1A1LMNAMAPTNPSR1KMT2A
SCHEMBL8799546 0.79 ALDH1A1 (0.39) RAB9AALDH1A1TP53LMNAMAPT
SCHEMBL7822840 0.79 POLB (0.44) TYK2JAK2JAK1RAB9AALDH1A1

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
EP-0757682-A1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-02-12 EP disclosed
WO-1995029907-A1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-09 WO disclosed