SCHEMBL22962153

SCHEMBL22962153

CCc1cc(F)cc(OCC#N)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
SLC2A1 P11166 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH2 P05091 1/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
POLB P06746 2/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
PSEN1 P49768 1/20 0.32
PSEN2 P49810 1/20 0.32
APH1B Q8WW43 1/20 0.32
NCSTN Q92542 1/20 0.32
APH1A Q96BI3 1/20 0.32

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
SCHEMBL2781336 0.83 SOD1 (0.39) L3MBTL1ALDH1A1GAASMN1; SMN2KDM4E
SCHEMBL13361876 0.80 FGFR1 (0.41) CYP4F2CYP4A11L3MBTL1ALDH1A1GAA
SCHEMBL3727145 0.75 EPAS1 (0.40) MAPT
SCHEMBL21263211 0.75 PFKFB3 (0.32) L3MBTL1ALDH1A1GAASMN1; SMN2KDM4E
SCHEMBL4487429 0.74 KDM4E (0.49) SLC2A1L3MBTL1ALDH1A1GAASMN1; SMN2
SCHEMBL22861004 0.74 MAPT (0.47) CYP4F2CYP4A11L3MBTL1ALDH1A1GAA
SCHEMBL17450484 0.74 FFAR4 (0.39) CYP4F2CYP4A11ALDH1A1GAAKDM4E
SCHEMBL241171 0.74 PTGS2 (0.43) CYP4F2CYP4A11ALDH1A1TSHR
SCHEMBL13006437 0.72 KAT6A (0.38) CYP4F2CYP4A11ALDH1A1GAASMN1; SMN2
SCHEMBL4476065 0.72 CYP2A6 (0.54) SLC2A1L3MBTL1ALDH1A1GAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210040087-A1 SOMATOSTATIN MODULATORS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-02-11 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 (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-20210040087-A1 SOMATOSTATIN MODULATORS AND USES THEREOF SSTR5, SSTR2, SSTR4 CYP4F2 3997/4885CYP4A11 2866/4885SLC2A1 566/4885

“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.