SCHEMBL5569274

SCHEMBL5569274

COc1cccc(NC(=O)N2CCN(c3ncccc3OCc3ccnc(NC(=O)O)c3)CC2)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LIMK2 P53671 1/20 0.51
▸ P2RY12 Q9H244 1/20 0.51
▸ MAPK1 P28482 3/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ KIT P10721 2/20 0.50
▸ LMNA P02545 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ TSHR P16473 1/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ HTT P42858 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ PDGFRB P09619 5/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ FAAH O00519 4/20 0.47

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
SCHEMBL12251021 0.93 P2RY12 (0.49) LIMK2P2RY12MAPK1ALDH1A1KIT
SCHEMBL5573600 0.89 TRPV1 (0.49) LIMK2P2RY12PDGFRBFAAH
SCHEMBL2423033 0.86 KIT (0.48) LIMK2P2RY12MAPK1ALDH1A1KIT
SCHEMBL12251013 0.86 PDGFRB (0.45) P2RY12MAPK1MAPTPDGFRB
SCHEMBL2385195 0.85 PDGFRB (0.44) P2RY12MAPK1KITMAPTPDGFRB
SCHEMBL2401520 0.85 MEN1 (0.50) P2RY12MAPK1MAPTPDGFRB
SCHEMBL12251020 0.85 TRPV1 (0.48) LIMK2KITPDGFRB
SCHEMBL2384052 0.81 LIMK2 (0.54) LIMK2P2RY12MAPK1ALDH1A1KIT
SCHEMBL2383727 0.80 DRD2 (0.51) P2RY12MAPK1ALDH1A1MAPTRAB9A
SCHEMBL2384354 0.79 RAB9A (0.47) LIMK2P2RY12ALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 — — US claimed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 — — 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-20070275952-A1 Tie-2 Modulators and Methods of Use TIE1, TEK, KDR LIMK2 328/4885P2RY12 1298/4885MAPK1 263/4885

“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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