SCHEMBL2932290

SCHEMBL2932290

CCN(CC)c1ccc2nc(Nc3ccccc3C(C)C)[nH]c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.47
SMN1; SMN2 Q16637 7/20 0.47
NPSR1 Q6W5P4 7/20 0.47
MEN1 O00255 7/20 0.47
KMT2A Q03164 7/20 0.47
LMNA P02545 7/20 0.47
HTT P42858 6/20 0.47
NPC1 O15118 5/20 0.47
KDM4E B2RXH2 3/20 0.47
HPGD P15428 3/20 0.47
POLB P06746 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
GAA P10253 2/20 0.47
ALDH1A1 P00352 2/20 0.46
RAB9A P51151 8/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
USP2 O75604 4/20 0.40
GPR35 Q9HC97 2/20 0.40

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
SCHEMBL2931072 0.91 SMN1; SMN2 (0.46) MAPTSMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL2932187 0.82 LMNA (0.64) MAPTSMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL14693664 0.80 DDX3X (0.39) MAPTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL14693654 0.80 DDX3X (0.39) MAPTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL2931962 0.80 GAA (0.50) MAPTSMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL14693663 0.79 GAA (0.61) MAPTSMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL2926003 0.77 SMN1; SMN2 (0.43) MAPTSMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL2925719 0.76 MEN1 (0.47) MAPTSMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL2931480 0.76 AKR1C3 (0.51) SMN1; SMN2NPSR1LMNAHTTHPGD
SCHEMBL2930206 0.76 RAB9A (0.43) MAPTSMN1; SMN2NPSR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7820821-B2 Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors TRANSTECH PHARMA, INC. (US) 2010-10-26 US disclosed
US-20100152170-A1 Benzazole Derivatives, Compositions, And Methods Of Use As Aurora Kinase Inhibitors TRANSTECH PHARMA, INC. (US) 2010-06-17 US disclosed
US-20070219235-A1 Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors VTVX HOLDINGS I LLC 2007-09-20 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 (2 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-20100152170-A1 Benzazole Derivatives, Compositions, And Methods Of Use As Aurora Kinase Inhibitors AURKC, AURKA, AURKB MAPT 1464/4885SMN1; SMN2 4734/4885NPSR1 4674/4885
US-20070219235-A1 Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors AURKC, AURKA, AURKB MAPT 1464/4885SMN1; SMN2 4734/4885NPSR1 4674/4885

“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.