SCHEMBL6565808

SCHEMBL6565808

CCC(=O)c1cc(N)ccc1OCc1ccc(C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 5/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
CYP1A2 P05177 3/20 0.44
CYP2C19 P33261 3/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C9 P11712 2/20 0.44
ALDH1A1 P00352 5/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
HPGD P15428 1/20 0.43
PARP10 Q53GL7 1/20 0.43
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41
MAOB P27338 2/20 0.40
RECQL P46063 2/20 0.40
FFAR1 O14842 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
FOLH1 Q04609 2/20 0.40

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
SCHEMBL6564598 0.90 SMN1; SMN2 (0.48) KMT2AMEN1MAPTSMN1; SMN2CYP1A2
SCHEMBL6566551 0.86 SMN1; SMN2 (0.49) MAPTSMN1; SMN2CYP1A2CYP2C19CYP3A4
SCHEMBL6564400 0.86 PDK2 (0.47) MAPTSMN1; SMN2CYP1A2CYP2C19CYP3A4
SCHEMBL6564644 0.86 RXRA (0.47) MAPTSMN1; SMN2CYP1A2CYP2C19CYP3A4
SCHEMBL6565713 0.83 KDM4A (0.39) MAPTALDH1A1FFAR1FFAR4LMNA
SCHEMBL6567935 0.80 CYP19A1 (0.54) KMT2AMEN1MAPTSMN1; SMN2CYP2C19
SCHEMBL22419890 0.79 ALDH1A1 (0.53) KMT2AMEN1MAPTSMN1; SMN2ALDH1A1
SCHEMBL6568009 0.77 PTGDR2 (0.55) KMT2AMEN1MAPTSMN1; SMN2CYP2C19
SCHEMBL11091418 0.76 FFAR4 (0.48) MAPTCYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL6565669 0.76 HTR2A (0.41) KMT2AMEN1MAPTSMN1; SMN2CYP1A2

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-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 KMT2A 3137/4885MEN1 4143/4885MAPT 4743/4885

“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.