SCHEMBL4299552

SCHEMBL4299552

COc1ccccc1NC(=S)N[C@@H]1CCCCC1N(C)C

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.65
▸ NPSR1 Q6W5P4 1/20 0.65
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ ALOX12 P18054 2/20 0.55
▸ HPGD P15428 2/20 0.55
▸ THRB P10828 1/20 0.55
▸ MAPT P10636 1/20 0.52
▸ GAA P10253 2/20 0.52
▸ TAS1R3 Q7RTX0 1/20 0.52
▸ TAS1R1 Q7RTX1 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ ALDH1A1 P00352 2/20 0.49
▸ PKM P14618 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
SCHEMBL4299548 1.00 LMNA (0.65) LMNANPSR1SMN1; SMN2ALOX12HPGD
SCHEMBL4305747 0.79 MAPT (0.52) LMNASMN1; SMN2ALOX12HPGDMAPT
SCHEMBL15250703 0.79 MAPT (0.52) LMNASMN1; SMN2ALOX12HPGDMAPT
SCHEMBL4305748 0.79 MAPT (0.52) LMNASMN1; SMN2ALOX12HPGDMAPT
SCHEMBL16274228 0.74 SMN1; SMN2 (0.48) LMNANPSR1SMN1; SMN2ALOX12THRB
SCHEMBL16274230 0.74 SMN1; SMN2 (0.48) LMNANPSR1SMN1; SMN2ALOX12THRB
SCHEMBL3822985 0.73 HPGD (0.80) LMNANPSR1SMN1; SMN2ALOX12HPGD
SCHEMBL31388324 0.73 HPGD (0.80) LMNANPSR1SMN1; SMN2ALOX12HPGD
SCHEMBL26154061 0.70 LMNA (0.61) LMNANPSR1SMN1; SMN2ALOX12HPGD
SCHEMBL31339240 0.69 SMN1; SMN2 (0.62) LMNANPSR1SMN1; SMN2ALOX12MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1640361-B9 ASYMMETRIC UREA COMPOUNDS AND PROCESS FOR PRODUCING ASYMMETRIC COMPOUNDS BY ASYMMETRIC CONJUGATE ADDITION REACTION USING THE SAME AS CATALYST SUMITOMO CHEMICAL CO (JP) 2015-11-04 — — EP disclosed
EP-1640361-B1 ASYMMETRIC UREA COMPOUNDS AND PROCESS FOR PRODUCING ASYMMETRIC COMPOUNDS BY ASYMMETRIC CONJUGATE ADDITION REACTION USING THE SAME AS CATALYST SUMITOMO CHEMICAL CO (JP) 2015-05-27 — — EP disclosed
US-7632970-B2 Asymmetric urea compound and process for producing asymmetric compound by asymmetric conjugate addition reaction with the same as catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-12-15 — — US disclosed
US-20060161006-A1 Asymmetric urea compound and process for producing asymmetric compound by asymmetric conjugate addition reaction with the same as catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-07-20 — — US disclosed
EP-1640361-A2 ASYMMETRIC UREA COMPOUND AND PROCESS FOR PRODUCING ASYMMETRIC COMPOUND BY ASYMMETRIC CONJUGATE ADDITION REACTION WITH THE SAME AS CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-03-29 — — 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-20060161006-A1 Asymmetric urea compound and process for producing asymmetric compound by asymmetric conjugate addition reaction with the same as catalyst RAD18, UTP18, UBE2G2 LMNA 4526/4885NPSR1 3126/4885SMN1; SMN2 3578/4885

“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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