SCHEMBL27410255

SCHEMBL27410255

OCC1CCCCC(Br)CCC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 6/20 0.38
▸ ESR2 Q92731 6/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ GBA1 P04062 2/20 0.31
▸ ADH1B P00325 1/20 0.30
▸ ADH1C P00326 1/20 0.30
▸ ADH1A P07327 1/20 0.30
▸ ADH4 P08319 1/20 0.30
▸ ADH7 P40394 1/20 0.30

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
SCHEMBL19916024 0.92 ESR1 (0.41) ESR1ESR2CYP3A4CYP2C9CYP2D6
SCHEMBL4890514 0.83 ESR1 (0.43) ESR1ESR2CYP3A4CYP2C9CYP2D6
SCHEMBL5625 0.83 — —
SCHEMBL5461 0.83 — —
SCHEMBL2936955 0.83 ESR2 (0.46) ESR1ESR2CYP3A4CYP2C9CYP2D6
SCHEMBL881445 0.82 — —
SCHEMBL10341459 0.80 — —
Cyclohexane SCHEMBL7799464 0.80 ESR1 (0.40) ESR1ESR2CYP3A4CYP2C9CYP2D6
SCHEMBL1906708 0.80 ESR1 (0.40) ESR1ESR2CYP3A4CYP2C9CYP2D6
SCHEMBL22289146 0.80 — —

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-2024119117-A1 MODIFIED 5' CAP FOR MRNA AND METHODS OF USE THEREOF PRIME MEDICINE, INC. (US) 2024-06-06 — — WO disclosed
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