SCHEMBL19110487

SCHEMBL19110487

N#Cc1ccc(-c2cnn3cc(-c4ccc(N5CCCCC5)cc4)cnc23)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACVR1 Q04771 11/20 0.62
KDR P35968 10/20 0.62
TGFBR1 P36897 9/20 0.62
PRKAB1 Q9Y478 8/20 0.62
BMPR1B O00238 9/20 0.56
ACVRL1 P37023 9/20 0.56
ACVR1B P36896 8/20 0.56
BMPR1A P36894 8/20 0.56
TGFBR2 P37173 7/20 0.56
BMPR2 Q13873 7/20 0.56
BMP4 P12644 2/20 0.51
FLT1 P17948 2/20 0.51
PRKAB2 O43741 1/20 0.51
LCK P06239 1/20 0.51
YES1 P07947 1/20 0.51
THRB P10828 1/20 0.51
SRC P12931 1/20 0.51
EIF2AK2 P19525 1/20 0.51
EPHA2 P29317 1/20 0.51
PRKAG1 P54619 1/20 0.51

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
SCHEMBL19110490 0.83 ACVR1B (0.59) ACVR1KDRTGFBR1PRKAB1BMPR1B
SCHEMBL19110488 0.81 ACVR1 (0.55) ACVR1KDRTGFBR1PRKAB1BMPR1B
SCHEMBL19110489 0.80 ACVR1 (0.57) ACVR1KDRTGFBR1PRKAB1BMPR1B
SCHEMBL17442185 0.80 RET (0.60) ACVR1KDRTGFBR1PRKAB1BMPR1B
SCHEMBL24409797 0.79 ACVR1 (0.74) ACVR1KDRTGFBR1PRKAB1BMPR1B
SCHEMBL13098159 0.77 KDM4E (0.59) THRB
SCHEMBL17531601 0.77 PRKAB1 (0.62) ACVR1KDRTGFBR1PRKAB1BMPR1B
SCHEMBL15996329 0.77 ACVR1 (1.00) ACVR1KDRTGFBR1PRKAB1BMPR1B
SCHEMBL25424497 0.76 KDR (0.47) ACVR1KDRTGFBR1PRKAB1BMPR1B
SCHEMBL25423868 0.75 KDR (0.49) ACVR1KDRTGFBR1PRKAB1BMPR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170197968-A1 Compositions and Methods for Inhibiting BMP NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-07-13 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 (1 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-20170197968-A1 Compositions and Methods for Inhibiting BMP BMP1, BMP2, BMPR2 ACVR1 12/4885KDR 217/4885TGFBR1 45/4885

“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.