SCHEMBL5649705

SCHEMBL5649705

Cc1cc(C(=O)NCCCN2CCOCC2)ccc1-c1nc2cc(C(F)(F)F)ccc2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.49
CD274 Q9NZQ7 1/20 0.49
POLB P06746 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2D6 P10635 1/20 0.47
TSHR P16473 2/20 0.47
EPHX2 P34913 2/20 0.47
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
FLT3 P36888 2/20 0.45
HTT P42858 2/20 0.45
USP2 O75604 1/20 0.45
HSD17B10 Q99714 1/20 0.45
NPSR1 Q6W5P4 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
SCHEMBL5649698 0.94 FLT3 (0.50) MAPK14CD274POLBSMN1; SMN2CYP2C9
SCHEMBL5650223 0.91 CD274 (0.50) MAPK14CD274POLBSMN1; SMN2CYP2C9
SCHEMBL5648132 0.91 TSHR (0.52) MAPK14CD274POLBSMN1; SMN2CYP2C9
SCHEMBL5650888 0.90 CYP2D6 (0.58) CD274POLBSMN1; SMN2CYP2C9CYP2D6
SCHEMBL5649128 0.89 TSHR (0.51) CD274POLBSMN1; SMN2CYP2C9CYP2D6
SCHEMBL5653810 0.88 CD274 (0.59) MAPK14CD274POLBSMN1; SMN2CYP2C9
SCHEMBL5654271 0.86 KMT2A (0.56) MAPK14POLBCYP2C9CYP2D6TSHR
SCHEMBL5651622 0.85 TNKS2 (0.52) MAPK14POLBSMN1; SMN2CYP2C9CYP2D6
SCHEMBL5654035 0.85 CYP2D6 (0.53) MAPK14POLBSMN1; SMN2CYP2C9CYP2D6
SCHEMBL5650213 0.85 FLT3 (0.53) CD274POLBSMN1; SMN2CYP2C9CYP2D6

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-7220769-B2 Azolylbenzamides and analogues and their use for treating osteoporosis NIKEM RESEARCH S.R.L. (IT) 2007-05-22 US disclosed
US-20050038095-A1 Azolylbenzamides and analogues and their use for treating osteoporosis 3-V BIOSCIENCES, INC. 2005-02-17 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 (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-20050038095-A1 Azolylbenzamides and analogues and their use for treating osteoporosis NR0B2, NR0B1, NCOR1 MAPK14 1445/4885CD274 4868/4885POLB 2161/4885

“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.