SCHEMBL22149504

SCHEMBL22149504

CCC[C@@H](N)c1cc(C)cc(=O)o1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.44
CA9 Q16790 2/20 0.44
MAPT P10636 5/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
KDM4E B2RXH2 5/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 7/20 0.36
HTT P42858 3/20 0.36
HPGD P15428 4/20 0.35
RAB9A P51151 3/20 0.35
MAPK1 P28482 2/20 0.35
PON1 P27169 2/20 0.35
GAA P10253 2/20 0.35
PPARG P37231 1/20 0.35
MAPK10 P53779 1/20 0.35
NCOA2 Q15596 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
TAS1R3 Q7RTX0 2/20 0.35
TAS1R1 Q7RTX1 2/20 0.35
NPC1 O15118 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
SCHEMBL22149740 1.00 CA1 (0.44) CA1CA9MAPTSMN1; SMN2KDM4E
SCHEMBL22149723 0.81 MEN1 (0.44) CA9MAPTSMN1; SMN2KDM4EKMT2A
SCHEMBL22149253 0.81 MEN1 (0.44) CA9MAPTSMN1; SMN2KDM4EKMT2A
SCHEMBL22149509 0.78 MAPT (0.44) CA1CA9MAPTSMN1; SMN2KDM4E
SCHEMBL22149518 0.78 MAPT (0.44) CA1CA9MAPTSMN1; SMN2KDM4E
SCHEMBL22149256 0.78 MAPT (0.44) CA1CA9MAPTSMN1; SMN2KDM4E
SCHEMBL24264467 0.77 ALDH1A1 (0.42) MAPTSMN1; SMN2KDM4EKMT2AALDH1A1
SCHEMBL22149725 0.77 KDM4E (0.42) CA1CA9MAPTKDM4EALDH1A1
SCHEMBL22149507 0.77 TAS1R3 (0.36) TAS1R3TAS1R1HCAR2
SCHEMBL22149566 0.76 CYP2A6 (0.34) CA1MAPTALDH1A1RAB9A

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
EP-3898613-B1 ANTICANCER COMPOUNDS PHARMA MAR SA (ES) 2023-08-09 EP disclosed
US-20220056021-A1 ANTICANCER COMPOUNDS PHARMA MAR, S.A. (ES) 2022-02-24 US disclosed
WO-2020127194-A1 ANTICANCER COMPOUNDS PHARMA MAR, S.A. (ES) 2020-06-25 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-20220056021-A1 ANTICANCER COMPOUNDS TP53, MCL1, MYC CA1 3322/4885CA9 768/4885MAPT 3137/4885

“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.