SCHEMBL6177652

SCHEMBL6177652

CO/C=C1/N=C(Cc2ccccc2)OC1=O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.35
GPR55 Q9Y2T6 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
USP2 O75604 1/20 0.34
POLB P06746 1/20 0.34
TNNI3 P19429 1/20 0.34
CRHBP P24387 1/20 0.34
TNNT2 P45379 1/20 0.34
TNNC1 P63316 1/20 0.34
CRHR2 Q13324 1/20 0.34
TEK Q02763 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.33
SORT1 Q99523 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
SCHEMBL6177655 1.00 LTA4H (0.35) LTA4HGPR55MEN1KMT2AALDH1A1
SCHEMBL6180626 0.87 USP2 (0.34) LTA4HGPR55MEN1KMT2AALDH1A1
SCHEMBL6178031 0.85 ALDH1A1 (0.39) MEN1KMT2AALDH1A1MAPTUSP2
SCHEMBL6178028 0.85 ALDH1A1 (0.39) MEN1KMT2AALDH1A1MAPTUSP2
SCHEMBL6175600 0.84 USP2 (0.34) MEN1KMT2AUSP2SORT1
SCHEMBL6175596 0.84 USP2 (0.34) MEN1KMT2AUSP2SORT1
SCHEMBL6176914 0.83 ALDH1A1 (0.37) MEN1KMT2AALDH1A1MAPTUSP2
SCHEMBL6177463 0.83 SMN1; SMN2 (0.36) ALDH1A1USP2TEKSMN1; SMN2
SCHEMBL4001548 0.80 MMP9 (0.36) MEN1KMT2ASMN1; SMN2SORT1
SCHEMBL4003199 0.80 MMP9 (0.36) MEN1KMT2ASMN1; SMN2SORT1

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-20050176966-A1 Process for the preparation of pyrimidine derivative, intermediate therefor and process for the preparation thereof AJINOMOTO CO., INC. (JP) 2005-08-11 US disclosed
EP-1529778-A1 Production method of pyrimidine derivative, intermediate therefor Ajinomoto Co., Inc. (JP) 2005-05-11 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-20050176966-A1 Process for the preparation of pyrimidine derivative, intermediate therefor and process for the preparation thereof DPYD, WEE1, DCXR LTA4H 1177/4885GPR55 3985/4885MEN1 1538/4885

“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.