SCHEMBL21391991

SCHEMBL21391991

CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2ccccc2C(F)(F)F)c(C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.58
▸ POLB P06746 1/20 0.58
▸ RXFP1 Q9HBX9 2/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ HTT P42858 1/20 0.46
▸ PTPRC P08575 1/20 0.45
▸ KCNK3 O14649 3/20 0.44
▸ KCNK9 Q9NPC2 3/20 0.44
▸ PTGS1 P23219 1/20 0.44
▸ GRM4 Q14833 1/20 0.44
▸ RORC P51449 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ TUBB4A P04350 1/20 0.44
▸ TUBB P07437 1/20 0.44
▸ TUBA3C P0DPH7 1/20 0.44
▸ TUBA1B P68363 1/20 0.44
▸ TUBA4A P68366 1/20 0.44
▸ TUBB4B P68371 1/20 0.44

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
SCHEMBL24380053 0.92 RXFP1 (0.51) LMNAPOLBRXFP1SMN1; SMN2PTPRC
SCHEMBL21391963 0.85 RXFP1 (0.46) LMNAPOLBRXFP1SMN1; SMN2PTGS1
SCHEMBL7081238 0.83 RXFP1 (0.57) LMNAPOLBRXFP1SMN1; SMN2PTPRC
SCHEMBL21081939 0.82 RXFP1 (0.47) LMNAPOLBRXFP1RORC
SCHEMBL3424865 0.82 POLB (0.76) LMNAPOLBRXFP1SMN1; SMN2HTT
SCHEMBL19899690 0.80 RXFP1 (0.46) LMNAPOLBRXFP1RORCALDH1A1
SCHEMBL20577777 0.80 RXFP1 (0.53) RXFP1RORC
SCHEMBL29448788 0.78 RXFP1 (0.53) LMNAPOLBRXFP1PTPRCKCNK3
SCHEMBL24425915 0.77 CA12 (0.47) LMNAPOLBRXFP1RORCALDH1A1
SCHEMBL15052244 0.77 CFTR (0.64) —

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-20190292138-A1 DIAMINE COMPOUND AND METHOD FOR PRODUCING SAME LG CHEM, LTD. (KR) 2019-09-26 — — 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-20190292138-A1 DIAMINE COMPOUND AND METHOD FOR PRODUCING SAME DDC, CAD, AOC1 LMNA 2157/4885POLB 3439/4885RXFP1 3537/4885

“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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