SCHEMBL8814846

SCHEMBL8814846

Cc1ccc(-c2nc3c(Cc4ccccc4C(F)(F)F)cc(O)cc3[nH]2)cc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGAM O43451 5/20 0.39
▸ GAA P10253 5/20 0.39
▸ SI P14410 5/20 0.39
▸ MGAM2 Q2M2H8 5/20 0.39
▸ PTGES O14684 2/20 0.37
▸ TRPV1 Q8NER1 1/20 0.35
▸ PRMT5 O14744 1/20 0.35
▸ RPS6KA3 P51812 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ PKM P14618 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ DHODH Q02127 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ NFKB2 Q00653 1/20 0.34
▸ RELA Q04206 1/20 0.34

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
SCHEMBL8818927 0.88 MGAM (0.41) MGAMGAASIMGAM2PTGES
SCHEMBL8818638 0.81 PARP1 (0.45) MGAMGAASIMGAM2PTGES
SCHEMBL8816922 0.81 ACHE (0.43) MGAMGAASIMGAM2PRMT5
SCHEMBL8817000 0.80 PRMT5 (0.34) MGAMGAASIMGAM2PTGES
SCHEMBL8816636 0.80 ACHE (0.39) MGAMGAASIMGAM2PRMT5
SCHEMBL8814868 0.79 PRMT5 (0.32) MGAMGAASIMGAM2PTGES
SCHEMBL8814977 0.79 ACHE (0.46) MGAMGAASIMGAM2TRPV1
SCHEMBL8079568 0.77 ACHE (0.46) PRMT5DHODHLTA4H
SCHEMBL8817544 0.73 MGAM (0.50) MGAMGAASIMGAM2RPS6KA3
SCHEMBL8818857 0.72 PTGES (0.44) MGAMGAASIMGAM2PTGES

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
WO-1997033873-A1 METHODS OF TREATING OR PREVENTING INTERSTITIAL CYSTITIS ELI LILLY AND COMPANY (US) 1997-09-18 — — WO disclosed
WO-1997031635-A1 METHODS OF TREATING OR PREVENTING SLEEP APNEA ELI LILLY AND COMPANY (US) 1997-09-04 — — WO disclosed
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