SCHEMBL24099127

SCHEMBL24099127

O=c1c2cccn2c2ccc(F)cc2n1CCCO

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 5/20 0.61
▸ LMNA P02545 5/20 0.61
▸ TP53 P04637 10/20 0.61
▸ THRB P10828 1/20 0.61
▸ MAPT P10636 3/20 0.60
▸ MEN1 O00255 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ TDP1 Q9NUW8 1/20 0.55

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
SCHEMBL24098693 0.86 RXFP1 (0.69) RXFP1LMNATP53THRBMAPT
SCHEMBL24099252 0.84 RXFP1 (0.60) RXFP1LMNATP53THRBMAPT
SCHEMBL30380917 0.84 RXFP1 (0.60) RXFP1LMNATP53THRBMAPT
SCHEMBL24099052 0.83 TP53 (0.68) RXFP1LMNATP53THRBMAPT
SCHEMBL30380730 0.83 TP53 (0.68) RXFP1LMNATP53THRBMAPT
SCHEMBL24099006 0.82 RXFP1 (0.76) RXFP1LMNATP53THRBMAPT
SCHEMBL24121089 0.82 RXFP1 (0.62) RXFP1LMNATP53THRBMAPT
SCHEMBL24121070 0.81 RXFP1 (0.62) RXFP1LMNATP53THRBMAPT
SCHEMBL24120852 0.81 TP53 (0.74) RXFP1LMNATP53THRBMAPT
SCHEMBL24121079 0.81 TP53 (0.61) RXFP1LMNATP53THRBMAPT

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-2021252775-A1 HETEROCYCLIC COMPOUNDS AND IMAGING AGENTS FOR IMAGING HUNTINGTIN PROTEIN CHDI FOUNDATION, INC. (US) 2021-12-16 — — WO disclosed
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