SCHEMBL9922239

SCHEMBL9922239

CNc1cccc(C2=NN(c3ccc(NC(=O)NS(=O)(=O)c4ccc(C)s4)nc3)C(=O)C2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 1/20 0.34
ALDH1A1 P00352 1/20 0.33
FYN P06241 1/20 0.32
CNR1 P21554 1/20 0.32
MAPT P10636 2/20 0.32
F10 P00742 1/20 0.32
USP2 O75604 1/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 2/20 0.31
P2RY12 Q9H244 1/20 0.31
NPC1 O15118 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
BRD4 O60885 1/20 0.31
CREBBP Q92793 1/20 0.31
GAA P10253 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL12161737 0.92 FBP1 (0.40) TP53SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL13182877 0.90 SMN1; SMN2 (0.34) SMN1; SMN2ALDH1A1MAPTUSP2POLB
SCHEMBL12177302 0.90 MEN1 (0.38) SMN1; SMN2MEN1KMT2AALDH1A1MAPT
SCHEMBL9923266 0.90 CNR1 (0.40) TP53SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL9922238 0.89 TP53 (0.37) TP53SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL9922235 0.87 TP53 (0.42) TP53SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL9923270 0.85 TP53 (0.39) TP53SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL9923267 0.83 CNR1 (0.38) TP53SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL9923268 0.83 TP53 (0.36) TP53SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL9922418 0.82 FBP1 (0.42) SMN1; SMN2MEN1KMT2AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
US-8067428-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2011-11-29 US disclosed
US-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2010-09-16 US disclosed
US-20080194597-A1 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2008-08-14 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-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 TP53 4462/4885SMN1; SMN2 3108/4885MEN1 4498/4885
US-20080194597-A1 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PIGS, GP6, ASGR1 TP53 3851/4885SMN1; SMN2 3390/4885MEN1 4750/4885
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 TP53 4435/4885SMN1; SMN2 3093/4885MEN1 4499/4885

“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.