SCHEMBL5773533

SCHEMBL5773533

O=C(NC1CC1)c1cccc2cc(O)ccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMYD3 Q9H7B4 2/20 0.55
▸ KDR P35968 4/20 0.52
▸ DRD4 P21917 6/20 0.50
▸ AURKA O14965 3/20 0.50
▸ MET P08581 3/20 0.50
▸ TEK Q02763 3/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ P2RX7 Q99572 1/20 0.50
▸ AURKB Q96GD4 2/20 0.49
▸ ABL1 P00519 1/20 0.49
▸ LCK P06239 1/20 0.49
▸ LYN P07948 1/20 0.49
▸ FGR P09769 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ DPP4 P27487 1/20 0.48
▸ KCNH2 Q12809 1/20 0.48

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
SCHEMBL2747078 0.83 DRD4 (0.67) DRD4KDM4EALDH1A1HPGDDPP4
SCHEMBL17749168 0.82 KDR (0.49) SMYD3KDRDRD4AURKAMET
SCHEMBL6121152 0.79 NPC1 (0.57) KDRAURKAMETTEKNPC1
SCHEMBL381778 0.78 PLK1 (0.67) KDRAURKAMETTEKNPC1
SCHEMBL2751444 0.77 DRD4 (0.64) DRD4NPC1RAB9AMAPTKDM4E
SCHEMBL3954720 0.76 NPC1 (0.65) DRD4NPC1RAB9AMAPTKDM4E
SCHEMBL3456146 0.76 NPC1 (0.65) DRD4NPC1RAB9AMAPTKDM4E
SCHEMBL30073645 0.76 NPC1 (0.65) DRD4NPC1RAB9AMAPTKDM4E
SCHEMBL17749164 0.75 KMT2A (0.50) SMYD3KDRDRD4AURKAMET
SCHEMBL28348804 0.75 PLK1 (0.53) KDRAURKAMETTEKNPC1

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
EP-1660503-A1 NAPHTHALENE CARBOXAMIDES AND THEIR DERIVATIVES USEFUL AS NEW ANTI-ANGIOGENIC AGENTS PFIZER INC. (US) 2006-05-31 — — EP disclosed
US-20050070508-A1 Napthalene carboxamides and their derivatives useful as new anti-angiogenic agents AGOURON PHARMACEUTICALS, INC. 2005-03-31 — — US disclosed
WO-2005021553-A1 NAPHTHALENE CARBOXAMIDES AND THEIR DERIVATIVES USEFUL AS NEW ANTI-ANGIOGENIC AGENTS PFIZER INC. (US) 2005-03-10 — — WO 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-20050070508-A1 Napthalene carboxamides and their derivatives useful as new anti-angiogenic agents CCNA1, CCNA2, CCNT1 SMYD3 1755/4885KDR 30/4885DRD4 1672/4885

“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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