SCHEMBL30820600

SCHEMBL30820600

COCCOc1cc2ncnc(Nc3cc(Br)ccc3OC)c2cc1N

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FBP1 P09467 2/20 0.62
▸ EGFR P00533 10/20 0.61
▸ KDR P35968 12/20 0.55
▸ RET P07949 1/20 0.55
▸ KIF5B P33176 1/20 0.55
▸ FLT1 P17948 4/20 0.55
▸ FGFR1 P11362 3/20 0.55
▸ FLT4 P35916 2/20 0.55
▸ GAK O14976 2/20 0.54
▸ ERBB2 P04626 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ MAPK13 O15264 1/20 0.51
▸ ABL1 P00519 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CDK1 P06493 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ SRC P12931 1/20 0.51

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
SCHEMBL29168723 1.00 FBP1 (0.62) FBP1EGFRKDRRETKIF5B
SCHEMBL27152271 0.90 EGFR (0.73) FBP1EGFRKDRRETKIF5B
SCHEMBL30820457 0.90 EGFR (0.73) FBP1EGFRKDRRETKIF5B
SCHEMBL29168707 0.83 EGFR (0.61) FBP1EGFRKDRRETKIF5B
SCHEMBL30820387 0.83 EGFR (0.61) FBP1EGFRKDRRETKIF5B
SCHEMBL30820517 0.83 EGFR (0.64) FBP1EGFRKDRRETKIF5B
SCHEMBL7864780 0.80 KDR (0.83) FBP1EGFRKDRRETKIF5B
SCHEMBL30822108 0.79 EGFR (0.57) FBP1EGFRKDRRETKIF5B
Hydrochloric Acid SCHEMBL7866007 0.79 KDR (0.82) FBP1EGFRKDRRETKIF5B
Hydrochloric Acid SCHEMBL28028746 0.78 KDR (0.81) EGFRKDRRETKIF5BFLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240246940-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF VORONOI INC. (KR) 2024-07-25 — — US disclosed
CN-117693505-A Heteroaryl derivative compounds and uses thereof 沃若诺伊公司 2024-03-12 — — CN disclosed
EP-4328222-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF Voronoi Inc. (KR) 2024-02-28 — — 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-20240246940-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF ERBB2, EGFR, ERBB3 FBP1 3492/4885EGFR 2/4885KDR 24/4885

“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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