SCHEMBL16879552

SCHEMBL16879552

C=C(C)c1cnc(-c2cc(Cl)ccc2F)cc1Nc1ncccc1C(=O)OC

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 19/20 0.57
ACVR1B P36896 15/20 0.57
ACVRL1 P37023 11/20 0.57
ACVR1 Q04771 3/20 0.57
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL16879186 0.87 TGFBR1 (0.72) TGFBR1ACVR1BACVRL1ACVR1
SCHEMBL16879305 0.84 TGFBR1 (0.75) TGFBR1ACVR1BACVRL1ACVR1
SCHEMBL16879671 0.83 TGFBR1 (0.67) TGFBR1ACVR1BACVRL1ACVR1
SCHEMBL16879398 0.82 TGFBR1 (0.76) TGFBR1ACVR1BACVRL1ACVR1
SCHEMBL16879670 0.82 TGFBR1 (0.76) TGFBR1ACVR1BACVRL1ACVR1
SCHEMBL16879709 0.79 TGFBR1 (0.56) TGFBR1ACVR1BACVRL1ACVR1
SCHEMBL16879511 0.77 TGFBR1 (0.55) TGFBR1ACVR1BACVRL1ACVR1
SCHEMBL16879626 0.76 TGFBR1 (0.76) TGFBR1ACVR1BACVRL1ACVR1
SCHEMBL16888498 0.75 TGFBR1 (0.56) TGFBR1ACVR1BACVRL1ACVR1
SCHEMBL18219801 0.75 TGFBR1 (0.68) TGFBR1ACVR1BACVRL1ACVR1

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-11702401-B2 Compounds and methods of use MEDIVATION TECHNOLOGIES LLC (US) 2023-07-18 US disclosed
US-20220000847-A1 Compounds and Methods of Use MEDIVATION TECHNOLOGIES LLC (US) 2022-01-06 US disclosed
US-11053216-B2 Compounds and methods of use MEDIVATION TECHNOLOGIES LLC (US) 2021-07-06 US disclosed
EP-3089971-B1 COMPOUNDS AND METHODS OF USE MEDIVATION TECH LLC (US) 2020-07-29 EP disclosed
US-20200071296-A1 Compounds and Methods of Use MEDIVATION TECHNOLOGIES LLC 2020-03-05 US disclosed
US-20180208577-A1 Compounds and Methods of Use MEDIVATION TECHNOLOGIES LLC 2018-07-26 US disclosed
US-10030004-B2 Compounds and methods of use MEDIVATION TECHNOLOGIES LLC (US) 2018-07-24 US disclosed
US-20160326137-A1 Compounds and Methods of Use MEDIVATION TECHNOLOGIES LLC 2016-11-10 US disclosed
EP-3089971-A1 COMPOUNDS AND METHODS OF USE Medivation Technologies, Inc. (US) 2016-11-09 EP disclosed
WO-2015103355-A1 COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2015-07-09 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 (7 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-20220000847-A1 Compounds and Methods of Use TGFB2, TGFB1, HDGF TGFBR1 13/4885ACVR1B 150/4885ACVRL1 197/4885
US-11702401-B2 Compounds and methods of use TGFB2, TGFB1, HDGF TGFBR1 13/4885ACVR1B 150/4885ACVRL1 197/4885
US-10030004-B2 Compounds and methods of use TGFB2, TGFB1, HDGF TGFBR1 13/4885ACVR1B 150/4885ACVRL1 197/4885
US-20160326137-A1 Compounds and Methods of Use TGFB2, TGFB1, HDGF TGFBR1 13/4885ACVR1B 150/4885ACVRL1 197/4885
US-20200071296-A1 Compounds and Methods of Use TGFB2, TGFB1, HDGF TGFBR1 13/4885ACVR1B 150/4885ACVRL1 197/4885
US-11053216-B2 Compounds and methods of use TGFB2, TGFB1, HDGF TGFBR1 13/4885ACVR1B 150/4885ACVRL1 197/4885
US-20180208577-A1 Compounds and Methods of Use TGFB2, TGFB1, HDGF TGFBR1 13/4885ACVR1B 150/4885ACVRL1 197/4885

“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.