SCHEMBL22230646

SCHEMBL22230646

CCOC(=O)c1nocc1-c1ccc(Br)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TARBP2 Q15633 5/20 0.56
HTT P42858 1/20 0.50
MAPT P10636 5/20 0.47
CYP19A1 P11511 2/20 0.46
CACNA1F O60840 1/20 0.45
ABCB1 P08183 1/20 0.45
CACNA1D Q01668 1/20 0.45
CACNA1S Q13698 1/20 0.45
CACNA1C Q13936 1/20 0.45
MEN1 O00255 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
RECQL P46063 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 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
SCHEMBL9586704 0.86 LMNA (0.49) TARBP2MAPTMEN1NPC1RAB9A
SCHEMBL9585857 0.86 TARBP2 (0.56) TARBP2MAPTCYP19A1MEN1NPC1
SCHEMBL892693 0.86 TARBP2 (0.52) TARBP2MAPTCYP19A1MEN1NPC1
SCHEMBL22727456 0.77 TARBP2 (0.44) TARBP2HTTMAPTKMT2AKDM4E
Phenylacetylene SCHEMBL1704028 0.77 TARBP2 (0.44) TARBP2MAPTCYP19A1MEN1NPC1
SCHEMBL406405 0.77 SMN1; SMN2 (0.41) TARBP2MAPTMEN1NPC1RAB9A
SCHEMBL406805 0.77 ALDH1A1 (0.41) TARBP2MAPTMEN1NPC1RAB9A
SCHEMBL9586903 0.76 L3MBTL1 (0.50) TARBP2HTTMAPTL3MBTL1GABRA2
SCHEMBL9587202 0.76 TRPM8 (0.50) TARBP2HTTMAPTMEN1KMT2A
SCHEMBL2305862 0.76 ELANE (0.44) TARBP2HTTMAPTMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112771027-B Lysophosphatidic acid receptor antagonists and process for preparing the same 武汉朗来科技发展有限公司 2024-03-05 CN disclosed
US-20220079928-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONIST AND PREPARATION METHOD THEREFOR WUHAN LL SCIENCE AND TECHNOLOGY DEVELOPMENT CO., LTD. (CN) 2022-03-17 US disclosed
EP-3912975-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AND PREPARATION METHOD THEREFOR Wuhan LL Science And Technology Development Co., Ltd. (CN) 2021-11-24 EP disclosed
WO-2020147739-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AND PREPARATION METHOD THEREFOR 武汉朗来科技发展有限公司 2020-07-23 WO disclosed
WO-2020147739-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AND PREPARATION METHOD THEREFOR 武汉朗来科技发展有限公司 2020-07-23 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 (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-20220079928-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONIST AND PREPARATION METHOD THEREFOR LPAR1, LPAR2, LPAR4 TARBP2 4721/4885HTT 3117/4885MAPT 4780/4885

“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.