SCHEMBL7563004

SCHEMBL7563004

Cc1c(N2CCOCC2)ccc(C(N)=O)c1NC(=O)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.44
NPSR1 Q6W5P4 2/20 0.41
KDM4E B2RXH2 2/20 0.41
POLB P06746 1/20 0.41
ALOX12 P18054 1/20 0.41
SRPK1 Q96SB4 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
LMNA P02545 3/20 0.40
GAA P10253 2/20 0.40
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPK9 P45984 1/20 0.39
MAPK10 P53779 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HPGD P15428 1/20 0.38
PIK3CD O00329 1/20 0.38
PIK3C2B O00750 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
SCHEMBL7141105 0.81 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2MAPTMAPK9MAPK10
SCHEMBL6073272 0.70 MAPT (0.47) ALDH1A1NPSR1KDM4EPOLBSMN1; SMN2
SCHEMBL28516755 0.70 RAB9A (0.45) ALDH1A1NPSR1KDM4EPOLBSMN1; SMN2
SCHEMBL30798758 0.70 HPGD (0.45) ALDH1A1KDM4ESMN1; SMN2LMNAMAPT
SCHEMBL11527987 0.69 ALDH1A1 (0.67) ALDH1A1NPSR1KDM4EPOLBALOX12
SCHEMBL4996506 0.69 ALDH1A1 (0.63) ALDH1A1NPSR1KDM4EPOLBALOX12
SCHEMBL7089470 0.69 KDM4E (0.45) ALDH1A1KDM4EPOLBSMN1; SMN2LMNA
SCHEMBL14271380 0.67 KCNQ2 (0.53) ALDH1A1NPSR1SMN1; SMN2LMNAGAA
SCHEMBL827916 0.67 ALDH1A1 (0.48) ALDH1A1KDM4ESMN1; SMN2LMNAMAPT
SCHEMBL4945050 0.67 KCNQ2 (0.55) ALDH1A1NPSR1SMN1; SMN2MAPTL3MBTL1

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-20020165218-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. 2002-11-07 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-20020165218-A1 Materials and methods to potentiate cancer treatment DCK, CHEK2, CHEK1 ALDH1A1 3519/4885NPSR1 4453/4885KDM4E 2518/4885

“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.