SCHEMBL14197601

SCHEMBL14197601

CCCCNc1ccc(C)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RRM2 P31350 2/20 0.48
▸ KCNH3 Q9ULD8 1/20 0.43
▸ HCAR3 P49019 1/20 0.41
▸ DDX3X O00571 1/20 0.40
▸ TLR8 Q9NR97 2/20 0.40
▸ TLR7 Q9NYK1 1/20 0.40
▸ KMT2A Q03164 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ PABPC1 P11940 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ MAPT P10636 3/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ ABL1 P00519 1/20 0.38
▸ KCNQ3 O43525 1/20 0.38
▸ KCNQ2 O43526 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38

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
SCHEMBL18386498 0.93 KCNH3 (0.48) RRM2KCNH3HCAR3DDX3XABL1
SCHEMBL12697198 0.89 RRM2 (0.46) RRM2HCAR3DDX3XMAPTKDM4E
SCHEMBL14308134 0.81 L3MBTL1 (0.47) KMT2ANPC1KDM4E
SCHEMBL3632606 0.80 ADRA2A (0.50) RRM2MAPTKCNQ3KCNQ2HDAC1
SCHEMBL7664958 0.80 RRM2 (0.47) RRM2KCNH3HCAR3TLR8KMT2A
SCHEMBL2171131 0.80 RRM2 (0.47) RRM2KCNH3HCAR3TLR8KMT2A
SCHEMBL25650053 0.79 STK17A (0.42) MAPTKCNQ3KCNQ2HDAC1HDAC8
SCHEMBL9347587 0.79 NPSR1 (0.40) KMT2AMEN1NPC1MAPTKDM4E
SCHEMBL20037762 0.79 MAPT (0.43) NPC1MAPTKDM4EHTTKCNQ3
SCHEMBL26559603 0.77 RRM2 (0.48) RRM2KCNH3HCAR3TLR8KMT2A

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-7354946-B2 prominent growth inhibitory activity against tumor cells; cyclin dependent kinase inhibitors; colon cancer; N'-(3-t-butylisoindolino[3,2-b]oxazolidin-4-on-8-yl)-N-(4-(N-benzylpyrrolidin-3-yl)pyridin-2-yl)urea BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-04-08 — — US disclosed
US-20070027147-A1 Biarylurea derivatives MSD K.K. (JP) 2007-02-01 — — 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-20070027147-A1 Biarylurea derivatives CDK6, CDK4, CCNI RRM2 325/4885KCNH3 2965/4885HCAR3 1967/4885

“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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