SCHEMBL25838140

SCHEMBL25838140

Cc1cc(Nc2ccc3nc(-c4cccc(Nc5ccnc6ccc(F)cc56)c4)[nH]c3c2)ccn1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 19/20 0.69
▸ MET P08581 5/20 0.52
▸ KDM4E B2RXH2 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45

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
SCHEMBL24006228 0.91 KDR (0.71) KDRMETKDM4EMEN1ALDH1A1
SCHEMBL24003904 0.91 KDR (0.71) KDRMETKDM4EMEN1ALDH1A1
SCHEMBL25820956 0.91 KDR (0.77) KDRMET
SCHEMBL25455011 0.83 KDR (0.71) KDRMETKDM4EMEN1ALDH1A1
SCHEMBL24006212 0.83 KDR (0.73) KDRMETKDM4EALDH1A1HPGD
SCHEMBL23999470 0.83 KDR (0.73) KDRMETKDM4EALDH1A1HPGD
SCHEMBL24009926 0.81 KDR (0.61) KDRMET
SCHEMBL24010184 0.79 KDR (0.49) KDR
SCHEMBL25826862 0.78 KDR (0.68) KDRMET
SCHEMBL24003905 0.78 KDR (0.58) KDR

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-20230219927-A1 AKT3 MODULATORS Georgiamune Inc. 2023-07-13 — — 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-20230219927-A1 AKT3 MODULATORS AKT3, AKT2, PIK3CA KDR 2851/4885MET 1110/4885KDM4E 4219/4885

“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.

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