SCHEMBL3098975

SCHEMBL3098975

CCNC(=O)c1ccc(O)c(N)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.55
KDM4E B2RXH2 2/20 0.48
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 5/20 0.45
GAA P10253 3/20 0.45
HPGD P15428 3/20 0.45
GFER P55789 2/20 0.45
MAPT P10636 2/20 0.45
THRB P10828 1/20 0.45
HTT P42858 1/20 0.45
PLEC Q15149 1/20 0.45
GCGR P47871 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
PDK2 Q15119 2/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HSD17B10 Q99714 2/20 0.41
HSP90AA1 P07900 1/20 0.41
USP2 O75604 1/20 0.41

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
SCHEMBL3112864 0.86 ALOX15 (0.51) ALOX15KDM4ELMNASMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL2952907 0.84 ALOX15 (0.56) ALOX15KDM4ELMNASMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL27687311 0.84 ALOX15 (0.56) ALOX15KDM4ELMNASMN1; SMN2ALDH1A1
SCHEMBL28051808 0.84 SMN1; SMN2 (0.62) ALOX15KDM4ELMNASMN1; SMN2ALDH1A1
SCHEMBL18083916 0.84 HDAC6 (0.60) KDM4EALDH1A1GAAMAPTHDAC6
SCHEMBL3250190 0.83 MAPT (0.59) ALOX15KDM4ELMNASMN1; SMN2ALDH1A1
SCHEMBL2648559 0.82 ALDH1A1 (0.58) ALOX15KDM4ELMNASMN1; SMN2ALDH1A1
SCHEMBL31442962 0.82 ALDH1A1 (0.58) ALOX15KDM4ELMNASMN1; SMN2ALDH1A1
SCHEMBL5270854 0.82 CA2 (0.60) SMN1; SMN2ALDH1A1MAPTTHRBMEN1
SCHEMBL5924414 0.82 CA2 (0.60) SMN1; SMN2ALDH1A1MAPTTHRBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7803822-B2 Triazole derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-28 US disclosed
US-20090105253-A1 Triazole Derivative and Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-04-23 US disclosed
EP-1867331-A1 TRIAZOLE DERIVATIVE AND THE USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2007-12-19 EP disclosed
EP-0141377-B1 METAL COMPLEXES HODOGAYA CHEMICAL CO., LTD. (JP) 1990-05-02 EP disclosed
US-4563409-A ELECTROGRAPHY HOGOHAYA CHEMICAL CO., LTD. (JP) 1986-01-07 US disclosed
EP-0141377-A2 Metal complexes HODOGAYA CHEMICAL CO., LTD. (JP) 1985-05-15 EP 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-20090105253-A1 Triazole Derivative and Use Thereof F2R, HRH4, F2RL3 ALOX15 1043/4885KDM4E 3414/4885LMNA 2020/4885

“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.