SCHEMBL17442452

SCHEMBL17442452

C[C@@H](O)c1cccc(-c2cnn3cc(-c4ccc(CCN5CCCC5)cc4)cnc23)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.51
FLT1 P17948 7/20 0.51
FLT4 P35916 5/20 0.51
PRKAB2 O43741 6/20 0.47
PRKAG1 P54619 6/20 0.47
PRKAA2 P54646 6/20 0.47
PRKAA1 Q13131 6/20 0.47
PRKAG3 Q9UGI9 6/20 0.47
PRKAG2 Q9UGJ0 6/20 0.47
PRKAB1 Q9Y478 6/20 0.47
ACVR1 Q04771 5/20 0.47
BMP4 P12644 4/20 0.47
BMPR1B O00238 3/20 0.47
BMPR1A P36894 3/20 0.47
ACVRL1 P37023 3/20 0.47
LCK P06239 2/20 0.47
SRC P12931 2/20 0.47
EPHA2 P29317 2/20 0.47
RPS6KA1 Q15418 2/20 0.47
MKNK1 Q9BUB5 2/20 0.47

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
SCHEMBL17442060 1.00 KDR (0.51) KDRFLT1FLT4PRKAB2PRKAG1
SCHEMBL17442204 0.99 KDR (0.53) KDRFLT1FLT4PRKAB2PRKAG1
SCHEMBL26876161 0.94 KDR (0.51) KDRFLT1FLT4PRKAB2PRKAG1
SCHEMBL26867388 0.93 KDR (0.51) KDRFLT1FLT4PRKAB2PRKAG1
SCHEMBL17442041 0.92 ACVR1 (0.49) KDRFLT1FLT4PRKAB2PRKAG1
SCHEMBL17442317 0.92 PRKAB1 (0.56) KDRFLT1FLT4PRKAB2PRKAG1
SCHEMBL17442106 0.92 PRKAB1 (0.56) KDRFLT1FLT4PRKAB2PRKAG1
SCHEMBL17442103 0.91 KDR (0.44) KDRFLT1FLT4PRKAB2PRKAG1
SCHEMBL17442104 0.91 KDR (0.44) KDRFLT1FLT4PRKAB2PRKAG1
SCHEMBL17442061 0.91 ACVR1 (0.53) KDRFLT1FLT4PRKAB2PRKAG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230398118-A1 METHODS OF TREATING CARDIOVASCULAR-RELATED DISEASE KEROS THERAPEUTICS, INC. 2023-12-14 US disclosed
US-20230372390-A1 METHODS OF TREATING LYMPHOPENIA KEROS THERAPEUTICS, INC. 2023-11-23 US disclosed
WO-2023081212-A1 METHODS OF USING ALK2 INHIBITORS KEROS THERAPEUTICS, INC. (US) 2023-05-11 WO disclosed
US-20220401445-A1 METHODS OF USING ALK2 INHIBITORS KEROS THERAPEUTICS, INC. 2022-12-22 US disclosed
WO-2022098812-A1 METHODS OF TREATING IRON OVERLOAD KEROS THERAPEUTICS, INC. (US) 2022-05-12 WO disclosed
WO-2022098821-A1 METHODS OF TREATING LYMPHOPENIA KEROS THERAPEUTICS, INC. (US) 2022-05-12 WO disclosed
WO-2022099166-A1 METHODS OF TREATING CARDIOVASCULAR-RELATED DISEASE KEROS THERAPEUTICS, INC. (US) 2022-05-12 WO disclosed
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
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
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
WO-2016011019-A1 COMPOSITIONS AND METHODS FOR INHIBITING BMP THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2016-01-21 WO disclosed
WO-2016011019-A1 COMPOSITIONS AND METHODS FOR INHIBITING BMP THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2016-01-21 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-20220401445-A1 METHODS OF USING ALK2 INHIBITORS ALK, ACVR2A, ACVR1 KDR 46/4885FLT1 165/4885FLT4 192/4885
US-20170197968-A1 Compositions and Methods for Inhibiting BMP BMP1, BMP2, BMPR2 KDR 217/4885FLT1 155/4885FLT4 234/4885
US-20230398118-A1 METHODS OF TREATING CARDIOVASCULAR-RELATED DISEASE BMPR2, BMP1, BMP2 KDR 138/4885FLT1 193/4885FLT4 203/4885
US-20230372390-A1 METHODS OF TREATING LYMPHOPENIA HAMP, BMPR2, BMP2 KDR 1564/4885FLT1 818/4885FLT4 1345/4885

“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.