SCHEMBL21936204

SCHEMBL21936204

C=Cc1cc(C)c(F)c(F)c1NCC(C)(C)O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ IL1B P01584 3/20 0.32
▸ TNF P01375 1/20 0.32

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
SCHEMBL25687481 0.88 — —
SCHEMBL21936193 0.85 IL1B (0.32) IL1BTNF
SCHEMBL21937293 0.77 IL1B (0.33) IL1BTNF
SCHEMBL21937323 0.76 — —
SCHEMBL21936267 0.75 IL1B (0.32) IL1BTNF
SCHEMBL21936811 0.74 — —
SCHEMBL19431556 0.74 — —
SCHEMBL21872860 0.73 — —
SCHEMBL21872814 0.72 IL1B (0.32) IL1B
SCHEMBL21936752 0.72 — —

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
EP-3633380-A1 METHOD FOR PREDICTING THERAPEUTIC EFFECT OF LSD1 INHIBITOR BASED ON EXPRESSION OF INSM1 Taiho Pharmaceutical Co., Ltd. (JP) 2020-04-08 — — EP disclosed
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