SCHEMBL4420502

SCHEMBL4420502

C=C1Oc2ccc(OC)c(-c3c4n(c5ccccc35)CCNC4)c2C1=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 12/20 0.38
HTR2A P28223 11/20 0.38
HTR6 P50406 2/20 0.34
HTR7 P34969 1/20 0.33
REN P00797 1/20 0.32
HTR2B P41595 1/20 0.31
NPC1 O15118 1/20 0.31
PIM1 P11309 1/20 0.31

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
SCHEMBL4420499 0.86 HTR2C (0.38) HTR2CHTR2AHTR6HTR7PIM1
SCHEMBL4421142 0.83 ALDH1A1 (0.36) HTR2CHTR2AHTR6HTR2BNPC1
SCHEMBL4557945 0.68 CYP1A1 (0.47) PIM1
Hydrochloric Acid SCHEMBL9573826 0.67 HTR2C (0.65) HTR2CHTR2A
Hydrochloric Acid SCHEMBL4591697 0.64 HTR2A (0.45) HTR2CHTR2AHTR6HTR7
SCHEMBL6294206 0.63 HTR2C (0.74) HTR2CHTR2A
Hydrochloric Acid SCHEMBL9382041 0.60 PRKCA (0.63)
SCHEMBL613000 0.60 MEN1 (0.54) HTR2CHTR2AREN
Hydrochloric Acid SCHEMBL9573793 0.59 HTR2C (0.51) HTR2CHTR2AHTR6
Hydrochloric Acid SCHEMBL7097944 0.59 HTR2C (0.51) HTR2CHTR2AHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090192147-A1 [a]-FUSED INDOLE COMPOUNDS, THEIR USE AS mTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-07-30 US 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-20090192147-A1 [a]-FUSED INDOLE COMPOUNDS, THEIR USE AS mTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES MTOR, RICTOR, PIK3C2A HTR2C 826/4885HTR2A 780/4885HTR6 1015/4885

“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.