SCHEMBL6566701

SCHEMBL6566701

COc1ccc(NC(=O)Nc2ccc(OC(c3ccc(Cl)cc3)c3ccccc3F)c(C(=O)NC(C)(C)C)c2)cc1OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.44
MAPT P10636 3/20 0.44
NPC1 O15118 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 7/20 0.43
IMPDH2 P12268 1/20 0.41
IMPDH1 P20839 1/20 0.41
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 4/20 0.41
LMNA P02545 2/20 0.41
ANO1 Q5XXA6 2/20 0.40
PNLIP P16233 1/20 0.40
HTT P42858 1/20 0.39
GPX4 P36969 1/20 0.39
TP53 P04637 1/20 0.39
GAA P10253 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL6566690 0.91 KMT2A (0.42) RAB9AMAPTNPC1SMN1; SMN2HPGD
SCHEMBL6565843 0.89 RAB9A (0.47) RAB9AMAPTNPC1SMN1; SMN2HPGD
SCHEMBL6566004 0.89 RAB9A (0.47) RAB9AMAPTNPC1SMN1; SMN2HPGD
SCHEMBL6566945 0.89 IMPDH2 (0.45) RAB9AMAPTSMN1; SMN2KMT2AIMPDH2
SCHEMBL6565693 0.88 SMN1; SMN2 (0.42) RAB9AMAPTNPC1SMN1; SMN2HPGD
SCHEMBL6566869 0.87 RAB9A (0.43) RAB9AMAPTNPC1SMN1; SMN2HPGD
SCHEMBL6565012 0.85 IMPDH2 (0.40) RAB9AMAPTNPC1SMN1; SMN2HPGD
SCHEMBL6567917 0.84 IMPDH2 (0.51) RAB9AMAPTKMT2AIMPDH2IMPDH1
SCHEMBL6566572 0.83 POLB (0.43) RAB9AMAPTNPC1SMN1; SMN2HPGD
SCHEMBL6564704 0.82 KMT2A (0.48) RAB9AMAPTNPC1SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-12-23 US claimed
EP-1437344-A1 BENZENE DERIVATIVES,PROCESS FOR PREPARING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2004-07-14 EP claimed
US-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-12-23 US disclosed
EP-1437344-A1 BENZENE DERIVATIVES,PROCESS FOR PREPARING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2004-07-14 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-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof HRH4, HRH2, HRH1 RAB9A 1322/4885MAPT 4743/4885NPC1 3521/4885

“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.