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SCHEMBL30522985

SCHEMBL30522985

C[C@@H]1CN(C(=O)C(F)(F)F)[C@@H](c2ccc(F)cc2)CN1C(=O)OC(C)(C)C.C[C@@H]1CN[C@@H](c2ccc(F)cc2)CN1C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TACR1 P25103 3/20 0.36
▸ RORC P51449 4/20 0.35
▸ NR1H2 P55055 4/20 0.33
▸ NR1H3 Q13133 4/20 0.33
▸ GPR119 Q8TDV5 1/20 0.33
▸ HTR7 P34969 1/20 0.32
▸ ABHD6 Q9BV23 1/20 0.31
▸ HDAC1 Q13547 1/20 0.31
▸ HDAC2 Q92769 1/20 0.31

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
SCHEMBL25326385 1.00 TACR1 (0.36) TACR1RORCNR1H2NR1H3GPR119
SCHEMBL25328193 0.90 TACR1 (0.41) TACR1RORCNR1H2NR1H3GPR119
SCHEMBL25917992 0.90 TACR1 (0.41) TACR1RORCNR1H2NR1H3GPR119
SCHEMBL30522995 0.90 TACR1 (0.35) TACR1RORCNR1H2NR1H3GPR119
SCHEMBL25326792 0.88 TACR1 (0.41) TACR1RORCNR1H2NR1H3GPR119
SCHEMBL25327368 0.88 TACR1 (0.41) TACR1RORCNR1H2NR1H3GPR119
SCHEMBL25327371 0.88 TACR1 (0.41) TACR1RORCNR1H2NR1H3GPR119
SCHEMBL25326478 0.88 GAA (0.35) NR1H2NR1H3HTR7HDAC2
SCHEMBL25326310 0.88 TACR1 (0.37) TACR1RORCNR1H2NR1H3GPR119
SCHEMBL25326396 0.88 TACR1 (0.37) TACR1RORCNR1H2NR1H3GPR119

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-4469445-A1 COMPOUNDS AND METHODS OF USE Tango Therapeutics, Inc. (US) 2024-12-04 — — EP disclosed