SCHEMBL3247173

SCHEMBL3247173

[CH2]c1ccc(CN(C)Cc2cccc(Oc3cncc(C)n3)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.36
KMT2A Q03164 3/20 0.35
F2 P00734 1/20 0.34
F10 P00742 1/20 0.34
MEN1 O00255 2/20 0.33
NOS1 P29475 2/20 0.33
PKM P14618 1/20 0.33
IGF1R P08069 1/20 0.33
NOS2 P35228 1/20 0.33
MAOB P27338 1/20 0.33
PTGES O14684 1/20 0.33
CALM1 P0DP23 1/20 0.33
CAMKK2 Q96RR4 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
SCHEMBL3243783 0.88 P2RX3 (0.39) ACHEKMT2AMEN1IGF1RMAOB
SCHEMBL3235759 0.79 CYP2D6 (0.40) KMT2ACALM1CAMKK2
SCHEMBL18617334 0.79 JAK2 (0.44) F2F10IGF1R
SCHEMBL2463239 0.78 IGF1R (0.40) KMT2AF10MEN1IGF1R
SCHEMBL18586073 0.77 F10 (0.44) F10IGF1R
SCHEMBL2456498 0.75 PRMT6 (0.43) NOS1IGF1RNOS2
SCHEMBL20672043 0.75 IGF1R (0.36) KMT2AF10MEN1IGF1R
SCHEMBL3239925 0.74 ACHE (0.32) ACHEPKMMAOB
SCHEMBL3247171 0.73 CASR (0.51) KMT2AMEN1IGF1R
SCHEMBL19206087 0.71 TRPV6 (0.50)

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-20100144733-A1 Compounds, compositions and methods comprising heteroaromatic derivatives INSTITUTE FOR ONEWORLD HEALTH 2010-06-10 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-20100144733-A1 Compounds, compositions and methods comprising heteroaromatic derivatives CFTR, PKD1, PKD2 ACHE 4393/4885KMT2A 4715/4885F2 1591/4885

“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.