SCHEMBL5577261

SCHEMBL5577261

Cc1ccc(CN2CCN(c3cccc(CNC(=O)c4ccc(F)cc4)c3)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HPGD P15428 1/20 0.51
KDM4E B2RXH2 2/20 0.50
MAPT P10636 2/20 0.50
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
HSD17B10 Q99714 1/20 0.50
PRKAA2 P54646 1/20 0.49
ALDH1A1 P00352 2/20 0.49
ITGB3 P05106 1/20 0.49
ITGA2B P08514 1/20 0.49
RAB9A P51151 1/20 0.49
MEN1 O00255 1/20 0.48
CYP2C19 P33261 1/20 0.48
KMT2A Q03164 1/20 0.48
CHRM3 P20309 1/20 0.48
MCHR1 Q99705 1/20 0.48

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
SCHEMBL5577761 0.91 CHRM3 (0.58) LMNASMN1; SMN2KDM4EMAPTTP53
SCHEMBL5577321 0.91 LMNA (0.56) LMNASMN1; SMN2HPGDKDM4EMAPT
SCHEMBL5577469 0.89 CHRM3 (0.49) LMNAKDM4EMAPTTP53TSHR
SCHEMBL5577620 0.89 HSD17B10 (0.60) LMNASMN1; SMN2HPGDKDM4EMAPT
SCHEMBL5577777 0.88 HSD17B10 (0.61) LMNASMN1; SMN2HPGDKDM4EMAPT
SCHEMBL5577300 0.88 ALDH1A1 (0.58) LMNASMN1; SMN2HPGDKDM4EMAPT
SCHEMBL5577510 0.88 CHRM3 (0.61) LMNASMN1; SMN2HPGDKDM4EMAPT
SCHEMBL5577719 0.87 CHRM3 (0.55) MAPTPRKAA2ALDH1A1ITGB3ITGA2B
SCHEMBL5577661 0.86 ALDH1A1 (0.59) LMNASMN1; SMN2HPGDKDM4EMAPT
SCHEMBL5577625 0.85 LMNA (0.61) LMNASMN1; SMN2HPGDKDM4EMAPT

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-20070043079-A1 Heterocyclic compound containing nitrogen atom and use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-02-22 US disclosed
EP-1616862-A1 NITROGENOUS HETEROCYCLIC COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-01-18 EP 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-20070043079-A1 Heterocyclic compound containing nitrogen atom and use thereof HLA-DRB1, MIF, HLA-C LMNA 4819/4885SMN1; SMN2 2012/4885HPGD 855/4885

“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.