SCHEMBL30217207

SCHEMBL30217207

C[C@@H](OCc1ccccc1)C(=O)N1Cc2ccc(C3(C)OC3C=O)cc2C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TMEM97 Q5BJF2 11/20 0.37
▸ SIGMAR1 Q99720 11/20 0.37
▸ HRH1 P35367 3/20 0.37
▸ HRH3 Q9Y5N1 3/20 0.37
▸ HTR1A P08908 2/20 0.37
▸ ADRA2C P18825 2/20 0.37
▸ HRH2 P25021 2/20 0.37
▸ ADRA2A P08913 1/20 0.37
▸ ADRA2B P18089 1/20 0.37
▸ DRD1 P21728 1/20 0.37
▸ HTR1B P28222 1/20 0.37
▸ HTR2A P28223 1/20 0.37
▸ HTR2C P28335 1/20 0.37
▸ HTR1E P28566 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ HTR2B P41595 1/20 0.37
▸ HDAC8 Q9BY41 2/20 0.35
▸ HCRTR2 O43614 2/20 0.34
▸ GPR183 P32249 1/20 0.34
▸ NAMPT P43490 1/20 0.34

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
SCHEMBL29237588 0.78 DPP8 (0.54) TMEM97SIGMAR1HRH1HRH3HTR1A
SCHEMBL30967882 0.78 DPP8 (0.54) TMEM97SIGMAR1HRH1HRH3HTR1A
SCHEMBL29237591 0.78 DPP8 (0.54) TMEM97SIGMAR1HRH1HRH3HTR1A
SCHEMBL20336587 0.66 HPGD (0.49) DPP7
SCHEMBL20336588 0.66 HPGD (0.49) DPP7
SCHEMBL20917399 0.65 HPGD (0.51) DPP7
SCHEMBL10626181 0.64 SIGMAR1 (0.45) SIGMAR1HTR1ASLC6A4
SCHEMBL29336684 0.63 MMP2 (0.34) —
SCHEMBL30216998 0.61 SIRT2 (0.43) HDAC1
SCHEMBL29237221 0.61 SIRT2 (0.43) HDAC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240279220-A1 INDOLE COMPOUNDS AND METHODS OF USE SIONNA THERAPEUTICS INC. 2024-08-22 — — US disclosed
EP-4396179-A1 INDOLE COMPOUNDS AND METHODS OF USE GENZYME CORPORATION (US) 2024-07-10 — — EP disclosed
WO-2023034992-A1 INDOLE COMPOUNDS AND METHODS OF USE GENZYME CORPORATION (US) 2023-03-09 — — 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-20240279220-A1 INDOLE COMPOUNDS AND METHODS OF USE CFTR, INMT, IDO1 TMEM97 1340/4885SIGMAR1 1267/4885HRH1 655/4885

“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.

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