SCHEMBL7879489

SCHEMBL7879489

Clc1c(Oc2cccnc2)sc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.44
▸ LMNA P02545 2/20 0.44
▸ PRSS12 P56730 2/20 0.43
▸ KMT2A Q03164 3/20 0.40
▸ GAA P10253 2/20 0.40
▸ CYP11B1 P15538 1/20 0.39
▸ CYP11B2 P19099 1/20 0.39
▸ LOXL2 Q9Y4K0 1/20 0.38
▸ CYP19A1 P11511 2/20 0.38
▸ MAPT P10636 3/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ HTT P42858 2/20 0.37
▸ NPSR1 Q6W5P4 3/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ MCL1 Q07820 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
SCHEMBL7670984 0.76 LOXL2 (0.43) TDP1LMNAKMT2AGAALOXL2
SCHEMBL7662062 0.74 MAPT (0.55) TDP1PRSS12KMT2AGAALOXL2
SCHEMBL7662066 0.74 LOXL2 (0.41) LMNAPRSS12KMT2AGAALOXL2
SCHEMBL7659816 0.74 ESR1 (0.44) KMT2AGAALOXL2MAPTSMN1; SMN2
SCHEMBL7666527 0.72 NPC1 (0.43) TDP1LMNAKMT2ALOXL2MAPT
SCHEMBL7667320 0.70 LOXL2 (0.43) TDP1LMNAKMT2AGAALOXL2
SCHEMBL8115743 0.69 TDP1 (0.49) TDP1LMNAKMT2ACYP11B1CYP11B2
SCHEMBL7661911 0.69 LOXL2 (0.42) TDP1GAALOXL2MAPTALDH1A1
SCHEMBL30535283 0.69 LMNA (0.82) TDP1LMNACYP11B1CYP11B2CYP19A1
SCHEMBL676142 0.69 LMNA (0.82) TDP1LMNACYP11B1CYP11B2CYP19A1

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
US-6333341-B1 TUMOR NECROSIS FACTOR, ANTIINFLAMMATORY AGENTS AND ANALGESICS AMGEN INC. 2001-12-25 — — US disclosed
US-6184237-B1 Substituted pyridine compounds and methods of use AMGEN INC. 2001-02-06 — — US disclosed
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