SCHEMBL20140398

SCHEMBL20140398

N#Cc1nc(Cc2ccccc2F)c2cnccn12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.34
NR1H3 Q13133 1/20 0.34
BUB1 O43683 4/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
AR P10275 1/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
ADRB2 P07550 1/20 0.32
BTK Q06187 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
GUCY1A1 Q02108 1/20 0.32
GUCY1B1 Q02153 1/20 0.32
KCNH2 Q12809 1/20 0.32
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL20141604 0.85 AR (0.38) L3MBTL1TDP1ARMEN1KMT2A
SCHEMBL14746744 0.77 ALDH1A1 (0.36) L3MBTL1TDP1ARNPC1RAB9A
SCHEMBL20140464 0.76 MAP2K3 (0.42) BUB1ARMEN1KMT2ARXFP1
SCHEMBL20140419 0.75 GUCY1A1 (0.37) BUB1L3MBTL1TDP1ARMEN1
SCHEMBL21787231 0.73 AR (0.36) ARNPC1RAB9AADRB2GUCY1A1
SCHEMBL20139673 0.71 AR (0.34) ARNPC1RAB9AALDH1A1KDM4E
SCHEMBL20139203 0.67 PTPN1 (0.43) L3MBTL1MEN1KMT2AALDH1A1KDM4E
SCHEMBL2022562 0.66 MAPK1 (0.47) CYP19A1L3MBTL1NPC1RAB9AALDH1A1
SCHEMBL3583183 0.64 GUCY1A1 (0.44) L3MBTL1TDP1NPC1MEN1KMT2A
SCHEMBL20142239 0.62 PTPN1 (0.41) L3MBTL1RAB9AMEN1KMT2ARXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12435080-B2 sGC stimulators TISENTO THERAPEUTICS INC. (US) 2025-10-07 US disclosed
US-20220017515-A1 sGC STIMULATORS TISENTO THERAPEUTICS INC. 2022-01-20 US disclosed
US-20220017515-A1 sGC STIMULATORS TISENTO THERAPEUTICS INC. 2022-01-20 US disclosed
US-11180493-B2 SGC stimulators CYCLERION THERAPEUTICS, INC. (US) 2021-11-23 US disclosed
US-11180493-B2 SGC stimulators CYCLERION THERAPEUTICS, INC. (US) 2021-11-23 US disclosed
US-20200071318-A1 SGC STIMULATORS TISENTO THERAPEUTICS INC. 2020-03-05 US disclosed
US-20200071318-A1 SGC STIMULATORS TISENTO THERAPEUTICS INC. 2020-03-05 US disclosed
EP-3538520-A2 SGC STIMULATORS Cyclerion Therapeutics, Inc. (US) 2019-09-18 EP disclosed
WO-2018089330-A2 SGC STIMULATORS IRONWOOD PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed
WO-2018089330-A2 SGC STIMULATORS IRONWOOD PHARMACEUTICALS, INC. (US) 2018-05-17 WO 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 (4 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-20200071318-A1 SGC STIMULATORS GUCY1A2, GMPS, PDE2A CYP19A1 2615/4885NR1H3 1524/4885BUB1 4677/4885
US-20220017515-A1 sGC STIMULATORS GUCY1A2, PRKG1, PDE2A CYP19A1 2719/4885NR1H3 1571/4885BUB1 4675/4885
US-12435080-B2 sGC stimulators GUCY1A2, PRKG1, PDE2A CYP19A1 2719/4885NR1H3 1571/4885BUB1 4675/4885
US-11180493-B2 SGC stimulators GUCY1A2, GMPS, PDE2A CYP19A1 2615/4885NR1H3 1524/4885BUB1 4677/4885

“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.