SCHEMBL21628482

SCHEMBL21628482

CCc1ccc(Oc2ncc(C(=O)OC)cc2F)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
VNN1 O95497 1/20 0.44
LMNA P02545 2/20 0.43
MAPT P10636 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PTGER4 P35408 4/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
HSP90AA1 P07900 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PTGER2 P43116 1/20 0.40
MAPK1 P28482 1/20 0.39
P2RX3 P56373 3/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
MAOB P27338 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38

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
SCHEMBL21628424 0.91 VNN1 (0.42) VNN1LMNAMAPTPTGER4NPC1
SCHEMBL21628713 0.89 MDH1 (0.48) VNN1LMNAMAPTNPC1RAB9A
SCHEMBL21628642 0.89 MAOB (0.48) LMNAMAPTL3MBTL1PTGER4RAB9A
SCHEMBL21628478 0.88 MAPT (0.50) MAPTSMN1; SMN2
SCHEMBL21628506 0.88 RXRA (0.49) VNN1MAPTL3MBTL1PTGER4NPC1
SCHEMBL21656917 0.88 PLK1 (0.49) VNN1MAPTL3MBTL1PTGER4SMN1; SMN2
SCHEMBL21628870 0.88 PTGER4 (0.45) VNN1MAPTL3MBTL1PTGER4PTGER2
SCHEMBL21628473 0.87 MAPT (0.49) MAPTSMN1; SMN2
SCHEMBL21628389 0.87 CHEK2 (0.45) VNN1MAPTL3MBTL1PTGER4MAOB
SCHEMBL21628625 0.87 TDP1 (0.46) LMNAMAPTL3MBTL1PTGER4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12600696-B2 Aromatic compounds Xeniopro GmbH (DE) 2026-04-14 US disclosed
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-12-21 US disclosed
US-20230150923-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-05-18 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2022-11-03 US disclosed
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2021-04-15 US disclosed
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2020-01-30 US disclosed
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2020-01-30 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 (7 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-20230150923-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK VNN1 1705/4885LMNA 3327/4885MAPT 2272/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK VNN1 1705/4885LMNA 3327/4885MAPT 2272/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK VNN1 1880/4885LMNA 3083/4885MAPT 2195/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK VNN1 1705/4885LMNA 3327/4885MAPT 2272/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR VNN1 3798/4885LMNA 832/4885MAPT 4404/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK VNN1 1705/4885LMNA 3327/4885MAPT 2272/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK VNN1 1705/4885LMNA 3327/4885MAPT 2272/4885

“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.