SCHEMBL22667347

SCHEMBL22667347

CCCN1C(=O)Cc2cc(Br)ccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BMPR1B O00238 6/20 0.51
BMPR1A P36894 6/20 0.51
TGFBR1 P36897 6/20 0.51
ACVRL1 P37023 6/20 0.51
ACVR1 Q04771 6/20 0.51
BRD4 O60885 2/20 0.43
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
IDO1 P14902 1/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
HBB P68871 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CASP2 P42575 1/20 0.38

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
SCHEMBL27675467 0.90 BMPR1B (0.43) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL27655367 0.88 CNR1 (0.44) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL27675339 0.88 CNR1 (0.44) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL745614 0.87 BRD4 (0.55) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL25899986 0.84 BMPR1B (0.50) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL16064620 0.84 SLC6A4 (0.43) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL21011997 0.84 BMPR1A (0.54) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL22667292 0.81 BMPR1B (0.55) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL30403475 0.81 BMPR1B (0.55) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL31356492 0.81 BMPR1B (0.46) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265096-A1 APOL1 INHIBITORS AND METHODS OF USE HERCULES CAPITAL, INC., AS AGENT 2023-08-24 US disclosed
US-11160797-B2 Pyridinone derivatives and their use as selective ALK-2 inhibitors NOVARTIS AG (CH) 2021-11-02 US disclosed
US-20200360357-A1 Pyridinone derivatives and their use as selective ALK-2 inhibitors NOVARTIS AG (CH) 2020-11-19 US disclosed
CN-1934114-A Substituted sym-triindole IHARA CHEMICAL IND CO (JP) 2007-03-21 CN 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 (3 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-20230265096-A1 APOL1 INHIBITORS AND METHODS OF USE APOL1, APOB, LDLR BMPR1B 2037/4885BMPR1A 1194/4885TGFBR1 463/4885
US-20200360357-A1 Pyridinone derivatives and their use as selective ALK-2 inhibitors ALK, ACVR2B, ACVR1B BMPR1B 637/4885BMPR1A 1313/4885TGFBR1 51/4885
US-11160797-B2 Pyridinone derivatives and their use as selective ALK-2 inhibitors ALK, ACVR2B, ACVR1B BMPR1B 637/4885BMPR1A 1313/4885TGFBR1 51/4885

“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.