SCHEMBL15870732

SCHEMBL15870732

Cc1cccc(OCC(=O)NCc2ccccc2)c1

nearest known ligand 0.79

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.73
▸ HPGD P15428 1/20 0.73
▸ SMN1; SMN2 Q16637 3/20 0.69
▸ GLA P06280 1/20 0.69
▸ MEN1 O00255 1/20 0.68
▸ L3MBTL1 Q9Y468 1/20 0.67
▸ MAPT P10636 2/20 0.63
▸ HTT P42858 3/20 0.62
▸ ALDH1A1 P00352 3/20 0.61
▸ CYP2C19 P33261 1/20 0.61
▸ KDM4E B2RXH2 1/20 0.60
▸ PPARD Q03181 1/20 0.60

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
SCHEMBL5272168 0.85 KMT2A (1.00) KMT2AHPGDSMN1; SMN2MEN1L3MBTL1
SCHEMBL17656854 0.84 KMT2A (0.79) KMT2AHPGDSMN1; SMN2MEN1L3MBTL1
SCHEMBL14032740 0.84 HTT (0.82) KMT2AHPGDSMN1; SMN2MEN1L3MBTL1
SCHEMBL14112019 0.83 KMT2A (0.73) KMT2AHPGDSMN1; SMN2MEN1L3MBTL1
SCHEMBL13458590 0.82 KMT2A (0.67) KMT2AHPGDSMN1; SMN2MEN1MAPT
SCHEMBL29951626 0.81 KMT2A (0.69) KMT2AHPGDSMN1; SMN2MEN1L3MBTL1
SCHEMBL4781790 0.80 LSS (0.74) KMT2AHPGDMEN1L3MBTL1HTT
SCHEMBL1695939 0.80 KMT2A (0.88) KMT2AHPGDSMN1; SMN2MEN1L3MBTL1
SCHEMBL14900387 0.80 KMT2A (0.71) KMT2AHPGDSMN1; SMN2MEN1L3MBTL1
SCHEMBL7606595 0.79 KMT2A (0.70) KMT2AHPGDMEN1L3MBTL1MAPT

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-9056862-B2 Thioxothiazolidine derivative having Ras function inhibitory effect NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2015-06-16 — — US disclosed
US-20140194412-A1 THIOXOTHIAZOLIDINE DERIVATIVE HAVING RAS FUNCTION INHIBITORY EFFECT KNC LABORATORIES CO., LTD. (JP) 2014-07-10 — — 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-20140194412-A1 THIOXOTHIAZOLIDINE DERIVATIVE HAVING RAS FUNCTION INHIBITORY EFFECT KRAS, NRAS, RASSF5 KMT2A 1805/4885HPGD 3414/4885SMN1; SMN2 4684/4885

“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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