SCHEMBL5019765

SCHEMBL5019765

CC1=C(c2ccc(NC(=O)c3cnccc3C)cc2)CN(c2nnn(C)n2)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 1/20 0.37
CSNK1E P49674 1/20 0.37
SMYD3 Q9H7B4 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.35
TYK2 P29597 1/20 0.35
PTPN11 Q06124 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HTT P42858 1/20 0.35
CREBBP Q92793 1/20 0.35
MAPT P10636 3/20 0.34
HPGD P15428 1/20 0.34
NAMPT P43490 2/20 0.34
ACKR3 P25106 1/20 0.34
NPC1 O15118 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 2/20 0.33
RAB9A P51151 2/20 0.33
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL5019605 0.93 L3MBTL1 (0.35) L3MBTL1TYK2PTPN11SMN1; SMN2HTT
SCHEMBL5019613 0.91 CSNK1D (0.38) CSNK1DCSNK1ESMYD3L3MBTL1TYK2
SCHEMBL5019602 0.90 SMYD3 (0.36) CSNK1DCSNK1ESMYD3L3MBTL1TYK2
SCHEMBL5019713 0.90 SMYD3 (0.37) CSNK1DCSNK1ESMYD3TYK2PTPN11
SCHEMBL1781495 0.90 RAB9A (0.38) L3MBTL1TYK2PTPN11MAPTHPGD
SCHEMBL986998 0.90 STIM1 (0.42) CSNK1DCSNK1EL3MBTL1PTPN11HTT
SCHEMBL5019742 0.87 MAPT (0.39) L3MBTL1PTPN11SMN1; SMN2MAPTNPC1
SCHEMBL4561040 0.86 KMT2A (0.35) L3MBTL1PTPN11MAPTNPC1RAB9A
SCHEMBL5019717 0.84 CRACR2A (0.39) HPGD
SCHEMBL5019627 0.83 CSNK1D (0.37) CSNK1DCSNK1ESMYD3PTPN11NAMPT

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-20130289071-A1 TETRAZOLYL-TETRAHYDROPYRIDINE COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2013-10-31 US disclosed
WO-2012064808-A1 TETRAZOLYL - TETRAHYDROPYRIDINE COMPOUNDS FOR INFLAMMATION AND IMMUNE - RELATED USES SYNTA PHARMACEUTICALS CORP (US) 2012-05-18 WO 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-20130289071-A1 TETRAZOLYL-TETRAHYDROPYRIDINE COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES TSLP, IL5, TPMT CSNK1D 1304/4885CSNK1E 1660/4885SMYD3 2684/4885

“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.