SCHEMBL20906148

SCHEMBL20906148

CC(=O)n1ccc2c(Br)cc(C)cc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 4/20 0.45
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 2/20 0.37
LMNA P02545 2/20 0.37
MYC P01106 1/20 0.36
CYP11B1 P15538 3/20 0.35
CYP11B2 P19099 3/20 0.35
HPGD P15428 3/20 0.35
TP53 P04637 1/20 0.35
KMT2A Q03164 1/20 0.32
PDGFRA P16234 1/20 0.32
CDK5 Q00535 1/20 0.32
TYRO3 Q06418 1/20 0.32
RAB9A P51151 2/20 0.31
NPC1 O15118 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL18585522 0.78 NOTUM (0.41) NOTUMALDH1A1KDM4EHSD17B10CYP11B1
SCHEMBL30559961 0.76 NOTUM (0.65) NOTUMALDH1A1KDM4EHSD17B10CYP11B1
SCHEMBL21624075 0.76 NOTUM (0.65) NOTUMALDH1A1KDM4EHSD17B10CYP11B1
SCHEMBL19662830 0.73 NOTUM (0.45) NOTUMALDH1A1KDM4EHSD17B10CYP11B1
SCHEMBL10274544 0.70 NOTUM (0.59) NOTUMALDH1A1KDM4EHSD17B10LMNA
SCHEMBL31386179 0.69 SYK (0.33) ALDH1A1LMNAMYCKMT2AL3MBTL1
SCHEMBL14727014 0.69 P2RX3 (0.32)
SCHEMBL28487278 0.69
SCHEMBL23360886 0.69 NOTUM (0.49) NOTUMALDH1A1KDM4EHSD17B10CYP11B1
SCHEMBL22517610 0.68 KMT2A (0.40) NOTUMALDH1A1KDM4ELMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3344604-B1 CARBOXY SUBSTITUTED (HETERO) AROMATIC RING DERIVATIVES AND PREPARATION METHOD AND USES THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2020-11-04 EP disclosed
US-10266496-B2 Carboxy substituted (hetero) aromatic ring derivatives and preparation method and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2019-04-23 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-10266496-B2 Carboxy substituted (hetero) aromatic ring derivatives and preparation method and uses thereof XDH, ABCG2, SLC7A1 NOTUM 1994/4885ALDH1A1 871/4885KDM4E 2400/4885

“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.