SCHEMBL9907325

SCHEMBL9907325

COC(=O)c1ccc2nccc(-c3ccccc3)c2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.55
HTT P42858 1/20 0.55
PIK3CA P42336 1/20 0.51
EGFR P00533 1/20 0.50
NEK1 Q96PY6 2/20 0.49
SGK1 O00141 1/20 0.49
CAMKK2 Q96RR4 1/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
PTGS2 P35354 1/20 0.48
TGFBR1 P36897 1/20 0.47
KDM4E B2RXH2 1/20 0.47
KDM6B O15054 1/20 0.47
KDM5C P41229 1/20 0.47
KDM4C Q9H3R0 1/20 0.47
KDM2A Q9Y2K7 1/20 0.47
KDM3A Q9Y4C1 1/20 0.47
AXL P30530 1/20 0.46
FGFR1 P11362 1/20 0.45
MAPT P10636 2/20 0.45

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
SCHEMBL29245472 0.89 PIK3CA (0.51) ALOX15HTTPIK3CANEK1MEN1
SCHEMBL9907326 0.84 PIK3CA (0.57) PIK3CACAMKK2MEN1KMT2AKDM4E
SCHEMBL9907404 0.84 ALOX15 (0.52) ALOX15HTTMEN1KMT2ATGFBR1
SCHEMBL9909216 0.84 EGLN2 (0.47) ALOX15HTTTGFBR1KDM4EKDM6B
SCHEMBL9907398 0.84 ALOX15 (0.46) ALOX15HTTPIK3CAEGFRSGK1
SCHEMBL9909202 0.83 HTT (0.51) ALOX15HTTCAMKK2TGFBR1KDM4E
SCHEMBL15500539 0.82 PIK3CA (0.55) PIK3CACAMKK2MEN1KMT2ATGFBR1
SCHEMBL16549247 0.82 MAPT (0.50) ALOX15HTTPIK3CAEGFRSGK1
SCHEMBL9909187 0.81 HTT (0.46) ALOX15HTTTGFBR1KDM4EKDM6B
SCHEMBL16549268 0.81 AXL (0.47) ALOX15HTTNEK1TGFBR1AXL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11780821-B2 Inhibitors of fibroblast activation protein Praxis Biotech LLC (US) 2023-10-10 US disclosed
US-11780821-B2 Inhibitors of fibroblast activation protein Praxis Biotech LLC (US) 2023-10-10 US disclosed
US-11780821-B2 Inhibitors of fibroblast activation protein Praxis Biotech LLC (US) 2023-10-10 US disclosed
CN-112105354-A Fibroblast activation protein inhibitor 普拉西斯生物技术有限责任公司 2020-12-18 CN disclosed
US-20190185451-A1 INHIBITORS OF FIBROBLAST ACTIVATION PROTEIN Praxis Biotech LLC 2019-06-20 US disclosed
US-20190185451-A1 INHIBITORS OF FIBROBLAST ACTIVATION PROTEIN Praxis Biotech LLC 2019-06-20 US disclosed
US-8853242-B2 Nitrogenous-ring acylguanidine derivative ASTELLAS PHARMA INC. (JP) 2014-10-07 US disclosed
US-8853242-B2 Nitrogenous-ring acylguanidine derivative ASTELLAS PHARMA INC. (JP) 2014-10-07 US disclosed
EP-2463276-B1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC (JP) 2014-03-12 EP disclosed
EP-2463276-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2012-06-13 EP disclosed
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 US disclosed
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 US disclosed
WO-2011016504-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE アステラス製薬株式会社 (JP) 2011-02-10 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 (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-20190185451-A1 INHIBITORS OF FIBROBLAST ACTIVATION PROTEIN FAP, FIBP, FRS2 ALOX15 3025/4885HTT 3896/4885PIK3CA 502/4885
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE HTR5A, HTR2A, HTR1E ALOX15 1101/4885HTT 970/4885PIK3CA 3492/4885
US-11780821-B2 Inhibitors of fibroblast activation protein FAP, FIBP, FRS2 ALOX15 3025/4885HTT 3896/4885PIK3CA 502/4885

“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.