SCHEMBL9907326

SCHEMBL9907326

O=C(O)c1ccc2nccc(-c3ccccc3)c2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 2/20 0.57
IP6K1 Q92551 5/20 0.52
IP6K3 Q96PC2 5/20 0.52
IP6K2 Q9UHH9 5/20 0.52
ALDH1A1 P00352 3/20 0.52
TP53 P04637 1/20 0.52
HSD17B10 Q99714 1/20 0.52
KDM4E B2RXH2 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
CAMKK1 Q8N5S9 2/20 0.50
CAMKK2 Q96RR4 2/20 0.50
NPC1 O15118 2/20 0.50
GAA P10253 2/20 0.50
RAB9A P51151 2/20 0.50
HPGD P15428 1/20 0.50
LMNA P02545 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
KDM4C Q9H3R0 4/20 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
SCHEMBL15500539 0.88 PIK3CA (0.55) PIK3CAIP6K1IP6K3IP6K2ALDH1A1
SCHEMBL9907325 0.84 ALOX15 (0.55) PIK3CAALDH1A1KDM4ESMN1; SMN2CAMKK2
SCHEMBL12874476 0.84 PIK3CA (0.51) PIK3CAIP6K1IP6K3IP6K2ALDH1A1
SCHEMBL6862365 0.84 PIK3CA (0.51) PIK3CAALDH1A1KDM4ESMN1; SMN2CAMKK1
SCHEMBL9907402 0.83 PIK3CA (0.44) PIK3CAIP6K1IP6K3IP6K2ALDH1A1
SCHEMBL9909160 0.83 SLC22A12 (0.58) PIK3CACAMKK1CAMKK2KDM4CKDM5A
SCHEMBL9907406 0.82 KDM4C (0.52) IP6K1IP6K3IP6K2ALDH1A1TP53
SCHEMBL9907787 0.82 PIK3CA (0.49) PIK3CA
SCHEMBL9909215 0.80 RXRA (0.52) IP6K1IP6K3IP6K2SMN1; SMN2KDM4C
SCHEMBL9907363 0.80 DOT1L (0.44) IP6K1IP6K3IP6K2ALDH1A1TP53

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 12 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
EP-3723753-A1 INHIBITORS OF FIBROBLAST ACTIVATION PROTEIN Praxis Biotech LLC (US) 2020-10-21 EP 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
WO-2019118932-A1 INHIBITORS OF FIBROBLAST ACTIVATION PROTEIN Praxis Biotech LLC (US) 2019-06-20 WO 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
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

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 PIK3CA 502/4885IP6K1 970/4885IP6K3 1275/4885
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE HTR5A, HTR2A, HTR1E PIK3CA 3492/4885IP6K1 4169/4885IP6K3 4056/4885
US-11780821-B2 Inhibitors of fibroblast activation protein FAP, FIBP, FRS2 PIK3CA 502/4885IP6K1 970/4885IP6K3 1275/4885

“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.