SCHEMBL20140391

SCHEMBL20140391

N#Cc1nn(Cc2ccccc2F)c2cnccc12

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BUB1 O43683 14/20 0.48
ROCK2 O75116 1/20 0.41
PKM P14618 2/20 0.40
PKLR P30613 2/20 0.40
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
GRM2 Q14416 1/20 0.36
GUCY1B2 O75343 1/20 0.36
GUCY1A2 P33402 1/20 0.36
GUCY1A1 Q02108 1/20 0.36
GUCY1B1 Q02153 1/20 0.36

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
SCHEMBL20140465 0.90 BUB1 (0.50) BUB1PKMPKLR
SCHEMBL4245514 0.85 BUB1 (0.49) BUB1PKMPKLRMEN1KMT2A
SCHEMBL23162021 0.81 PKM (0.41) BUB1PKMPKLRMEN1KMT2A
SCHEMBL15117027 0.79 PDE5A (0.50) BUB1PKMPKLRGUCY1A1GUCY1B1
SCHEMBL23161937 0.79 BUB1 (0.44) BUB1PKMPKLRMEN1KMT2A
SCHEMBL23161968 0.78 BUB1 (0.39) BUB1PKMPKLR
SCHEMBL20140328 0.78 BUB1 (0.37) BUB1PKMPKLRMEN1KMT2A
SCHEMBL15169434 0.77 PDE5A (0.50) BUB1PKMPKLRMEN1KMT2A
SCHEMBL23161936 0.76 NR1H2 (0.41) BUB1PKMPKLRMEN1KMT2A
SCHEMBL20141852 0.76 GRM2 (0.45) BUB1MEN1KMT2AGRM2

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 BUB1 4677/4885ROCK2 447/4885PKM 1415/4885
US-20220017515-A1 sGC STIMULATORS GUCY1A2, PRKG1, PDE2A BUB1 4675/4885ROCK2 429/4885PKM 1427/4885
US-12435080-B2 sGC stimulators GUCY1A2, PRKG1, PDE2A BUB1 4675/4885ROCK2 429/4885PKM 1427/4885
US-11180493-B2 SGC stimulators GUCY1A2, GMPS, PDE2A BUB1 4677/4885ROCK2 447/4885PKM 1415/4885

“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.