SCHEMBL25311698

SCHEMBL25311698

CS(=O)(=O)OCCn1ccc2cc(F)c(F)cc21

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 7/20 0.55
HTR2C P28335 7/20 0.55
P2RX7 Q99572 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
HTR2B P41595 1/20 0.38
NPY5R Q15761 1/20 0.38
HTT P42858 1/20 0.37
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
MCL1 Q07820 2/20 0.33
MTNR1A P48039 2/20 0.33
MTNR1B P49286 2/20 0.33
HTR7 P34969 1/20 0.33

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
SCHEMBL25310969 0.84 HTR2C (0.49) HTR2AHTR2CP2RX7NPY5RHTT
SCHEMBL25309043 0.84 HTR2C (0.49) HTR2AHTR2CP2RX7NPY5RHTT
SCHEMBL27358260 0.79 HTT (0.39) HTR2AHTR2CHTTHDAC1HDAC6
SCHEMBL5428812 0.78 HTT (0.60) HTR2AHTR2CCYP1A2CYP3A4HTT
SCHEMBL8647472 0.74 CYP19A1 (0.35) HTR2CCYP1A2CYP2C9HTR2BHTT
SCHEMBL25309823 0.73 HTR2A (0.64) HTR2AHTR2CP2RX7CYP1A2CYP3A4
SCHEMBL31561791 0.73 HTR2A (0.64) HTR2AHTR2CP2RX7CYP1A2CYP3A4
SCHEMBL24669584 0.72 EPHX2 (0.37) HTTHDAC6MTNR1AMTNR1B
SCHEMBL30515265 0.72 HTR2A (0.63) HTR2AHTR2CP2RX7CYP1A2CYP3A4
SCHEMBL25310206 0.72 HTR2A (0.63) HTR2AHTR2CP2RX7CYP1A2CYP3A4

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
US-20250136548-A1 FUNCTIONALIZED ALKYLAMINES TERRAN BIOSCIENCES INC (US) 2025-05-01 US disclosed
WO-2023141595-A2 FUNCTIONALIZED ALKYLAMINES TERRAN BIOSCIENCES, INC. (US) 2023-07-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250136548-A1 FUNCTIONALIZED ALKYLAMINES BDNF, HTR2A, NTRK2 HTR2A 2/4885HTR2C 6/4885P2RX7 274/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.