SCHEMBL18010744

SCHEMBL18010744

Cc1ccc(C(=O)N2CCN(C)CC2)c(F)c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CPS1 P31327 4/20 0.57
EPHX2 P34913 1/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
LMNA P02545 2/20 0.54
TSHR P16473 2/20 0.54
HTT P42858 2/20 0.54
MAPT P10636 1/20 0.54
HRH4 Q9H3N8 5/20 0.51
TP53 P04637 1/20 0.50
ALOX15 P16050 1/20 0.50
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
HSP90AA1 P07900 1/20 0.47
CNR1 P21554 1/20 0.46

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
SCHEMBL7870100 0.94 CPS1 (0.59) CPS1EPHX2MEN1KMT2ALMNA
SCHEMBL18311852 0.91 MEN1 (0.59) CPS1EPHX2MEN1KMT2ALMNA
SCHEMBL7872416 0.88 CPS1 (0.57) CPS1EPHX2MEN1KMT2ALMNA
SCHEMBL7878686 0.87 CPS1 (0.60) CPS1LMNATSHRHTTMAPT
SCHEMBL13841322 0.86 KDM4E (0.63) CPS1EPHX2MEN1KMT2ALMNA
SCHEMBL12205464 0.86 CPS1 (0.58) CPS1MEN1KMT2ALMNATSHR
SCHEMBL7871464 0.84 HTT (0.53) CPS1MEN1KMT2ALMNATSHR
SCHEMBL11961209 0.84 HRH4 (0.54) MEN1KMT2ALMNATSHRHTT
SCHEMBL13503857 0.84 POLB (0.61) MEN1KMT2ALMNATSHRHTT
SCHEMBL7870107 0.84 CPS1 (0.54) CPS1LMNATSHRHTTMAPT

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-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators ILDONG PHARMACEUTICAL CO., LTD. (KR) 2023-11-28 US disclosed
US-9840517-B2 Compound inhibiting activities of BTK and/or JAK3 kinases Beijing Hanmi Pharmaceutical Co., Ltd. (CN) 2017-12-12 US disclosed
US-20160229865-A1 COMPOUND INHIBITING ACTIVITIES OF BTK AND/OR JAK3 KINASES Beijing Hanmi Pharmaceutical Co., Ltd. (CN) 2016-08-11 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-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators PDE4A, PDE4B, PDE5A CPS1 3443/4885EPHX2 1339/4885MEN1 4307/4885
US-20160229865-A1 COMPOUND INHIBITING ACTIVITIES OF BTK AND/OR JAK3 KINASES BTK, JAK3, JAK2 CPS1 4565/4885EPHX2 3693/4885MEN1 3586/4885

“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.