Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30833404

CC(F)(C1CCCCN1C(=O)Nc1ccnnc1)S(=O)(=O)c1cccc(F)c1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.40
TSHR P16473 2/20 0.38
WNT3 P56703 1/20 0.38
SFRP1 Q8N474 1/20 0.38
USP2 O75604 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP2C9 P11712 2/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPT P10636 1/20 0.36
EPHX2 P34913 1/20 0.35
ABCC9 O60706 1/20 0.35
ABCC8 Q09428 1/20 0.35
KCNJ11 Q14654 1/20 0.35
KCNJ8 Q15842 1/20 0.35
ALDH1A1 P00352 3/20 0.35
RIPK1 Q13546 1/20 0.35

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
SCHEMBL30833383 0.91 MEN1 (0.42) RORCTSHRWNT3SFRP1USP2
SCHEMBL30833449 0.88 RORC (0.42) RORCTSHRWNT3SFRP1USP2
SCHEMBL30833387 0.86 ABCC9 (0.41) TSHRWNT3SFRP1USP2MEN1
Trifluoroacetic Acid SCHEMBL29529844 0.84 TSHR (0.47) RORCTSHRUSP2KMT2ACYP2C9
Trifluoroacetic Acid SCHEMBL17942549 0.84 TSHR (0.47) RORCTSHRUSP2KMT2ACYP2C9
SCHEMBL30833424 0.83 EGFR (0.39) TSHRWNT3SFRP1USP2MEN1
SCHEMBL30833438 0.83 NPSR1 (0.39) TSHRWNT3SFRP1USP2MEN1
SCHEMBL30833388 0.81 RIPK1 (0.38) USP2MEN1KMT2ANPSR1MAPT
SCHEMBL17949199 0.81 TSHR (0.48) RORCTSHRUSP2KMT2ACYP2C9
SCHEMBL17949198 0.81 TSHR (0.48) RORCTSHRUSP2KMT2ACYP2C9

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
CN-118164961-A 4-Methylsulfonyl substituted piperidine urea compounds for the treatment of Dilated Cardiomyopathy (DCM) 迈奥卡迪亚公司 2024-06-11 CN disclosed
CN-111393414-B 4-Methylsulfonyl substituted piperidine urea compounds for the treatment of Dilated Cardiomyopathy (DCM) 迈奥卡迪亚公司 2024-05-07 CN disclosed