SCHEMBL29848643

SCHEMBL29848643

CN1CCN(c2ccc(-c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2C(F)(F)F)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 1/20 0.53
CDK2 P24941 1/20 0.53
CCNA1 P78396 1/20 0.53
PIM1 P11309 1/20 0.49
CDK4 P11802 1/20 0.49
CCND3 P30281 1/20 0.49
MTOR P42345 1/20 0.49
GSK3B P49841 1/20 0.49
NPBWR1 P48145 8/20 0.46
WDR5 P61964 1/20 0.45
PDE3B Q13370 1/20 0.45
PDE3A Q14432 1/20 0.45
DGAT1 O75907 2/20 0.45
SOAT1 P35610 2/20 0.45
KCNH2 Q12809 2/20 0.45
MAPT P10636 3/20 0.44
HTT P42858 3/20 0.44
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
MMP2 P08253 1/20 0.44

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
SCHEMBL29848496 0.89 SLC6A9 (0.49) NPBWR1PDE3BPDE3ADGAT1SOAT1
SCHEMBL22982108 0.83 DGAT1 (0.48) CCNA2CDK2CCNA1PIM1CDK4
SCHEMBL29848546 0.83 DGAT1 (0.48) CCNA2CDK2CCNA1PIM1CDK4
SCHEMBL22982443 0.81 KCNH2 (0.52) NPBWR1DGAT1SOAT1KCNH2MAPT
SCHEMBL853678 0.80 CCNA2 (0.58) CCNA2CDK2CCNA1PIM1CDK4
SCHEMBL29848847 0.79 NPBWR1 (0.57) NPBWR1MAPTHTTRAB9ANPC1
SCHEMBL29848499 0.77 NPBWR1 (0.44) NPBWR1MAPTHTTRAB9ANPC1
SCHEMBL5564066 0.76 LMNA (0.58) CCNA2CDK2CCNA1PIM1CDK4
SCHEMBL4258177 0.76 NPBWR1 (0.58) NPBWR1MAPTHTTRAB9ANPC1
SCHEMBL10127582 0.73 SIRT6 (0.56) CCNA2CDK2CCNA1PIM1CDK4

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-12473278-B2 Imidazole derivative expressing FLT3 inhibitory activity, and use thereof INDUSTRY-UNIVERSITY COOPERATION FOUNDATION HANYANG UNIVERSITY ERICA CAMPUS (KR) 2025-11-18 US disclosed
US-20220315573-A1 Novel Imidazole Derivative Expressing FLT3 Inhibitory Activity, and Use Thereof Industry-University Cooperation Foundation Hangyang University Erica Campus (KR) 2022-10-06 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-20220315573-A1 Novel Imidazole Derivative Expressing FLT3 Inhibitory Activity, and Use Thereof FLT3, FLI1, MCL1 CCNA2 3368/4885CDK2 969/4885CCNA1 3334/4885
US-12473278-B2 Imidazole derivative expressing FLT3 inhibitory activity, and use thereof FLT3, FLI1, MCL1 CCNA2 3653/4885CDK2 960/4885CCNA1 3532/4885

“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.