SCHEMBL16753281

SCHEMBL16753281

COC(=O)Nc1ccc(C(=O)O)c(F)n1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SORT1 Q99523 12/20 0.39
NAPRT Q6XQN6 1/20 0.39
PIM1 P11309 1/20 0.38
ALDH1A1 P00352 1/20 0.37
PKM P14618 1/20 0.37
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALOX5 P09917 1/20 0.35

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
SCHEMBL19205217 0.85 ATR (0.39) SORT1MEN1KMT2A
SCHEMBL27461233 0.79 ADORA1 (0.43) POLBSORT1NAPRTALDH1A1SMN1; SMN2
SCHEMBL16753798 0.79 CSNK2A2 (0.44) ALDH1A1MEN1KMT2A
SCHEMBL38663529 0.75 ATR (0.49) ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL38661717 0.75 ATR (0.49) ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL15060517 0.73 ATR (0.39) MEN1HTTKMT2A
SCHEMBL9040184 0.73 TDP1 (0.66) POLBTDP1SORT1NAPRTALDH1A1
SCHEMBL7407900 0.71 KDM4E (0.50) POLBTDP1ALDH1A1SMN1; SMN2
Acetic Acid SCHEMBL29863168 0.70 PRMT1 (0.36) MEN1KMT2A
SCHEMBL7814205 0.70 NPC1 (0.44) POLBALDH1A1KMT2ASMN1; 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10717738-B2 Pyrimidinone and its derivatives inhibiting factor XIa ONO PHARMACEUTICAL CO., LTD. (JP) 2020-07-21 US disclosed
EP-3290413-B9 PYRIDINONE AND PYRIMIDINONE DERIVATIVES AS FACTOR XIA INHIBITORS ONO PHARMACEUTICAL CO (JP) 2020-04-29 EP disclosed
EP-3290413-B1 PYRIDINONE AND PYRIMIDINONE DERIVATIVES AS FACTOR XIA INHIBITORS ONO PHARMACEUTICAL CO (JP) 2019-11-13 EP disclosed
EP-3290413-A1 PYRIDINONE AND PYRIMIDINONE DERIVATIVES AS FACTOR XIA INHIBITORS ONO Pharmaceutical Co., Ltd. (JP) 2018-03-07 EP disclosed
EP-2794597-B1 PYRIDINONE AND PYRIMIDINONE DERIVATIVES AS FACTOR XIA INHIBITORS ONO PHARMACEUTICAL CO (JP) 2017-11-15 EP disclosed
US-20170305917-A1 COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2017-10-26 US disclosed
US-9732085-B2 Pyridinone and pyrimidinone derivatives as factor Xia ONO PHARMACEUTICAL CO., LTD. (JP) 2017-08-15 US disclosed
US-20150152112-A1 COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2015-06-04 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 (3 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-20150152112-A1 COMPOUNDS F11, F12, F10 POLB 3059/4885TDP1 1561/4885SORT1 1671/4885
US-20170305917-A1 COMPOUNDS F11, F12, F10 POLB 3059/4885TDP1 1561/4885SORT1 1671/4885
US-10717738-B2 Pyrimidinone and its derivatives inhibiting factor XIa F11, TFPI, F10 POLB 2922/4885TDP1 1247/4885SORT1 3246/4885

“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.