SCHEMBL24211441

SCHEMBL24211441

Cc1ccc(C(=O)Cl)cc1OCCOCC(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
BCHE P06276 5/20 0.39
ACHE P22303 5/20 0.39
RARB P10826 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
MEN1 O00255 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TTR P02766 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C8 P10632 1/20 0.36
CHRM1 P11229 1/20 0.36
CYP2C9 P11712 1/20 0.36
ADRA1A P35348 1/20 0.36
PPARG P37231 1/20 0.36
HTR2B P41595 1/20 0.36

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
SCHEMBL24211443 0.88 POLB (0.48) TSHRRARBMEN1KMT2A
SCHEMBL24211322 0.85 KDM4E (0.40) TTR
SCHEMBL14200146 0.79 SMN1; SMN2 (0.56) BCHEACHESMN1; SMN2L3MBTL1LMNA
SCHEMBL29038755 0.78 TSHR (0.41) TSHRBCHEACHEMEN1RAB9A
SCHEMBL14228281 0.78 TSHR (0.51) TSHRMEN1KMT2ASMN1; SMN2TDP1
SCHEMBL9202287 0.78 ALDH1A1 (0.51) TSHRMAPTHTT
SCHEMBL24211278 0.76 MYC (0.65) MEN1KMT2A
SCHEMBL15660519 0.74 MYC (0.54) TSHRMEN1KMT2A
SCHEMBL24211325 0.73 TTR (0.51) TSHRRAB9ATTRLMNAHTT
SCHEMBL22035 0.71 TSHR (0.50) TSHRTAS1R3TAS1R1MEN1RAB9A

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
US-20220017454-A1 OLIGO-BENZAMIDE ANALOGS AND THEIR USE IN CANCER TREATMENT BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-01-20 US 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-20220017454-A1 OLIGO-BENZAMIDE ANALOGS AND THEIR USE IN CANCER TREATMENT OGFR, OTC, HDAC6 TSHR 3324/4885BCHE 1913/4885ACHE 2118/4885

“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.