SCHEMBL4489488

SCHEMBL4489488

NC(=O)c1sc(-c2ccc3c(c2)CCO3)nc1Nc1ccccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 7/20 0.51
FABP3 P05413 4/20 0.51
FABP5 Q01469 2/20 0.51
CHEK1 O14757 10/20 0.49
PLA2G10 O15496 1/20 0.45
CCNE1 P24864 1/20 0.45
CDK2 P24941 1/20 0.45
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
NPC1 O15118 1/20 0.41
CLK1 P49759 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL3828856 0.92 FABP4 (0.56) FABP4FABP3FABP5CHEK1PLA2G10
SCHEMBL3825249 0.88 PLA2G10 (0.43) FABP4FABP3FABP5CHEK1PLA2G10
SCHEMBL4481685 0.86 NPC1 (0.55) FABP4FABP3FABP5CHEK1KDM4E
SCHEMBL13675570 0.83 FABP4 (0.47) FABP4FABP3FABP5CHEK1PLA2G10
SCHEMBL13674672 0.80 PLA2G10 (0.48) FABP4FABP3FABP5CHEK1PLA2G10
SCHEMBL976455 0.71 CDC7 (0.57) CHEK1PLA2G10CCNE1CDK2KDM4E
SCHEMBL1328083 0.70 PLA2G10 (0.60) CHEK1PLA2G10KDM4EALDH1A1NPC1
SCHEMBL29273322 0.70 SMN1; SMN2 (0.47) KDM4EALDH1A1NPC1RAB9A
SCHEMBL1830741 0.70 CHEK1 (0.69) FABP4FABP3FABP5CHEK1PLA2G10
SCHEMBL29273332 0.69 SMN1; SMN2 (0.48) KDM4EALDH1A1NPC1RAB9A

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-20090270456-A1 Novel chemical compounds HASEGAWA MASAICHI 2009-10-29 US claimed
US-20090270456-A1 Novel chemical compounds HASEGAWA MASAICHI 2009-10-29 US disclosed
US-20090270456-A1 Novel chemical compounds HASEGAWA MASAICHI 2009-10-29 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-20090270456-A1 Novel chemical compounds HIPK3, HIPK2, HIPK1 FABP4 3496/4885FABP3 796/4885FABP5 3065/4885

“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.