SCHEMBL10207290

SCHEMBL10207290

C=CCCC(N=C(c1ccccc1)c1ccccc1)C(C)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 1/20 0.45
KDM4E B2RXH2 1/20 0.40
AKT1 P31749 1/20 0.37
MAPT P10636 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 3/20 0.36
NPC1 O15118 2/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
ATM Q13315 1/20 0.36
OGG1 O15527 1/20 0.35
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 4/20 0.35
LMNA P02545 2/20 0.35
HPGD P15428 1/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34

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
SCHEMBL7401142 0.86 AAK1 (0.50) AAK1KDM4EAKT1MAPTRAB9A
SCHEMBL1876173 0.86 AAK1 (0.50) AAK1KDM4EMAPTPOLBRAB9A
SCHEMBL10166817 0.83 AAK1 (0.70) AAK1KDM4EMAPTHSD17B10NPC1
SCHEMBL894847 0.83 AAK1 (0.70) AAK1KDM4EMAPTHSD17B10NPC1
SCHEMBL19055964 0.81 AAK1 (0.46) AAK1KDM4EMAPTHSD17B10POLB
SCHEMBL16576947 0.78 AAK1 (0.44) AAK1KDM4EMAPTCYP1A2CYP2D6
SCHEMBL12583014 0.76 MDM2 (0.47) AAK1CYP1A2POLBRAB9ANPC1
SCHEMBL5779984 0.76 CYP2C19 (0.49) AAK1KDM4EAKT1MAPTHSD17B10
SCHEMBL5779979 0.76 CYP2C19 (0.49) AAK1KDM4EAKT1MAPTHSD17B10
SCHEMBL5779986 0.76 CYP2C19 (0.49) AAK1KDM4EAKT1MAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9994594-B2 Inhibitors of arginase and their therapeutic applications MARS, INCORPORATED (US) 2018-06-12 US disclosed
US-20170183362-A1 INHIBITORS OF ARGINASE AND THEIR THERAPEUTIC APPLICATIONS MARS, INCORPORATED 2017-06-29 US disclosed
US-9040703-B2 Inhibitors of arginase and their therapeutic applications MARS, INCORPORATED (US) 2015-05-26 US disclosed
US-20140371175-A1 INHIBITORS OF ARGINASE AND THEIR THERAPEUTIC APPLICATIONS MARS, INCORPORATED 2014-12-18 US disclosed
US-20120083469-A1 INHIBITORS OF ARGINASE AND THEIR THERAPEUTIC APPLICATIONS MARS, INCORPORATED 2012-04-05 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-20170183362-A1 INHIBITORS OF ARGINASE AND THEIR THERAPEUTIC APPLICATIONS ARG1, ARG2, PRMT9 AAK1 3518/4885KDM4E 804/4885AKT1 1727/4885
US-20120083469-A1 INHIBITORS OF ARGINASE AND THEIR THERAPEUTIC APPLICATIONS ARG1, ARG2, PRMT9 AAK1 3518/4885KDM4E 804/4885AKT1 1727/4885
US-20140371175-A1 INHIBITORS OF ARGINASE AND THEIR THERAPEUTIC APPLICATIONS ARG1, ARG2, PRMT9 AAK1 3518/4885KDM4E 804/4885AKT1 1727/4885

“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.