SCHEMBL5876419

SCHEMBL5876419

COC[C@](O)(c1ccccc1)c1ccc(OC)c(OC)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
KIF11 P52732 2/20 0.46
LMNA P02545 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
RECQL P46063 1/20 0.43
POLB P06746 1/20 0.40
CASP1 P29466 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1B1 Q16678 1/20 0.39
NR3C2 P08235 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
PDE5A O76074 1/20 0.38

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
SCHEMBL6618203 1.00 HTT (0.55) HTTSMN1; SMN2MEN1KMT2AKIF11
SCHEMBL6618200 1.00 HTT (0.55) HTTSMN1; SMN2MEN1KMT2AKIF11
SCHEMBL19884937 0.83 SMN1; SMN2 (0.47) HTTSMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL8784747 0.78 HTT (0.50) HTTSMN1; SMN2MEN1KMT2AKIF11
SCHEMBL5876465 0.77 KMT2A (0.49) HTTSMN1; SMN2MEN1KMT2AKIF11
SCHEMBL16674087 0.74 CYP1A1 (0.47) HTTSMN1; SMN2MEN1KMT2AKIF11
SCHEMBL11201308 0.74 CYP11B1 (0.53) HTTSMN1; SMN2MEN1KMT2APOLB
SCHEMBL11142840 0.74 HSP90AA1 (0.69) HTTSMN1; SMN2MEN1KMT2AKIF11
SCHEMBL30727454 0.73 HTT (0.53) HTTSMN1; SMN2MEN1KMT2AKIF11
SCHEMBL29172588 0.73 HTT (0.53) HTTSMN1; SMN2MEN1KMT2AKIF11

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-7119115-B2 Indazole or indole derivatives, and use thereof in human medicine and more particularly in oncology AVENTIS PHARMA S.A. (FR) 2006-10-10 US disclosed
US-20040162276-A1 Indazole or indole derivatives, and use thereof in human medicine and more particularly in oncology AVENTIS PHARMA S.A. (FR) 2004-08-19 US disclosed
EP-1414805-A1 INDAZOLE OR INDOLE DERIVATIVES, THEIR USE IN HUMAN MEDICINE AND MORE PARTICULARLY IN CANCEROLOGY Aventis Pharma S.A. (FR) 2004-05-06 EP disclosed
WO-2003011833-A1 INDAZOLE OR INDOLE DERIVATIVES, THEIR USE IN HUMAN MEDICINE AND MORE PARTICULARLY IN CANCEROLOGY AVENTIS PHARMA S.A. (FR) 2003-02-13 WO 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-20040162276-A1 Indazole or indole derivatives, and use thereof in human medicine and more particularly in oncology IDO1, IDO2, INMT HTT 1893/4885SMN1; SMN2 4244/4885MEN1 548/4885

“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.