SCHEMBL17616639

SCHEMBL17616639

Cc1ccc(OCc2ccccc2N)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.49
MAPT P10636 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
HPGD P15428 2/20 0.49
TSHR P16473 2/20 0.49
MAPK1 P28482 2/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
LMNA P02545 1/20 0.49
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
MRGPRX4 Q96LA9 1/20 0.46
SLC6A4 P31645 1/20 0.44
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
KMT2A Q03164 1/20 0.42
RELA Q04206 1/20 0.42
FFAR4 Q5NUL3 5/20 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
SCHEMBL16273692 0.86 FFAR4 (0.43) MRGPRX4SLC6A4FFAR4FFAR1
SCHEMBL20425118 0.84 MEN1 (0.45) MAPTSMN1; SMN2HPGDTSHRNPC1
SCHEMBL17616592 0.84 L3MBTL1 (0.51) L3MBTL1MAPTSMN1; SMN2HPGDMAPK1
SCHEMBL17616638 0.84 L3MBTL1 (0.50) L3MBTL1MAPTSMN1; SMN2TSHRLMNA
SCHEMBL17616640 0.84 MAPT (0.51) L3MBTL1MAPTSMN1; SMN2HPGDTSHR
SCHEMBL17616634 0.83 ALDH1A1 (0.39) MAPTRAB9ASLC6A4FFAR4FFAR1
SCHEMBL13793923 0.83 L3MBTL1 (0.51) L3MBTL1MAPTSMN1; SMN2HPGDTSHR
SCHEMBL7599662 0.83 CDK4 (0.46) L3MBTL1MAPTSMN1; SMN2TSHRMAPK1
SCHEMBL16920886 0.81 MRGPRX4 (0.47) L3MBTL1MAPTSMN1; SMN2HPGDTSHR
SCHEMBL17616594 0.81 FFAR1 (0.43) MAPTSMN1; SMN2LMNAMRGPRX4SLC6A4

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-9675072-B2 Tetrazolinone compound and application of same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-13 US disclosed
US-20160081340-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-03-24 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-20160081340-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME CYP2E1, MT-CO2, CASP3 L3MBTL1 458/4885MAPT 3398/4885SMN1; SMN2 2650/4885

“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.