SCHEMBL17268409

SCHEMBL17268409

CC/C=C/CNC(=O)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.46
ALDH1A1 P00352 4/20 0.45
POLB P06746 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CA3 P07451 2/20 0.39
CA5A P35218 2/20 0.39
CA5B Q9Y2D0 2/20 0.39
CA2 P00918 2/20 0.39
CA14 Q9ULX7 2/20 0.39
CA12 O43570 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CNR1 P21554 3/20 0.33
FAAH O00519 2/20 0.33
EPHX2 P34913 1/20 0.32
NR1H4 Q96RI1 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
SCHEMBL18262004 0.89 ALDH1A1 (0.54) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL18262005 0.89 ALDH1A1 (0.54) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL9431459 0.81 ALDH1A1 (0.46) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL9431466 0.81 ALDH1A1 (0.46) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL3180753 0.77 ALDH1A1 (0.46) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL3180746 0.77 ALDH1A1 (0.46) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL8975318 0.76 ALDH1A1 (0.42) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL8975320 0.76 ALDH1A1 (0.42) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL8615387 0.76 ALDH1A1 (0.50) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL19169987 0.75 ALDH1A1 (0.41) EPHX1ALDH1A1POLBSMN1; SMN2MEN1

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-9394297-B2 Amides as pim inhibitors AMGEN INC. (US) 2016-07-19 US disclosed
US-20150329538-A1 AMIDES AS PIM INHIBITORS AMGEN INC. (US) 2015-11-19 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-20150329538-A1 AMIDES AS PIM INHIBITORS PIM1, PIM3, PIM2 EPHX1 4039/4885ALDH1A1 720/4885POLB 3343/4885

“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.