SCHEMBL1277424

SCHEMBL1277424

CC(=Cc1ccc(-c2ccccc2O)cc1)C(=O)NC(=N)N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.44
HPGD P15428 3/20 0.37
ALDH1A1 P00352 2/20 0.37
BCL2L1 Q07817 1/20 0.37
HSD17B10 Q99714 1/20 0.37
RAB9A P51151 5/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
NPC1 O15118 3/20 0.36
DHODH Q02127 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.36
AKR1C3 P42330 1/20 0.36
HDAC1 Q13547 3/20 0.36
KDM1A O60341 3/20 0.36
HDAC6 Q9UBN7 2/20 0.36
ADAMTS4 O75173 1/20 0.35
STAT1 P42224 1/20 0.34
POLB P06746 1/20 0.34
F2 P00734 1/20 0.32
PRSS1 P07477 1/20 0.32
KCNH2 Q12809 1/20 0.32

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
SCHEMBL1277423 1.00 F10 (0.44) F10HPGDALDH1A1BCL2L1HSD17B10
SCHEMBL1277288 0.82 ALDH1A1 (0.44) F10HPGDALDH1A1HSD17B10RAB9A
SCHEMBL5426989 0.82 AKR1C3 (0.55) HPGDALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL5426994 0.82 AKR1C3 (0.55) HPGDALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL1277698 0.82 MAPT (0.36) F10HPGDRAB9ASMN1; SMN2NPC1
SCHEMBL1277330 0.81 PPM1B (0.38) F10HPGDALDH1A1HSD17B10RAB9A
SCHEMBL1277277 0.80 BACE1 (0.40) F10DHODHTRPM8PRSS1
SCHEMBL1277838 0.79 HSD17B1 (0.49) F10HPGDALDH1A1HSD17B10RAB9A
SCHEMBL1708751 0.79 HDAC2 (0.43) F10ALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL1277207 0.79 HSD17B1 (0.42) F10DHODHTRPM8HDAC1KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088737-A2 NOVEL ACYL GUANIDINE DERIVATIVES AJINOMOTO CO., INC (JP) 2012-04-12 US disclosed
US-20110082109-A1 NOVEL ACYL GUANIDINE DERIVATIVES AJINOMOTO CO., INC. (JP) 2011-04-07 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 (2 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-20110082109-A1 NOVEL ACYL GUANIDINE DERIVATIVES SLC9A3, NHERF1, SLC9A2 F10 4727/4885HPGD 1322/4885ALDH1A1 1459/4885
US-20120088737-A2 NOVEL ACYL GUANIDINE DERIVATIVES SLC9A3, NHERF1, SLC9A2 F10 4727/4885HPGD 1322/4885ALDH1A1 1459/4885

“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.