SCHEMBL3515822

SCHEMBL3515822

CCOB(O)c1cccnc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.38
CHRNA4 P43681 3/20 0.38
LMNA P02545 3/20 0.38
KMT2A Q03164 1/20 0.38
CCNC P24863 1/20 0.37
CDK8 P49336 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
RAB9A P51151 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
CYP19A1 P11511 2/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
NAPRT Q6XQN6 1/20 0.35

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
SCHEMBL26985702 0.83 LMNA (0.36) CHRNB2CHRNA4LMNAKMT2ACCNC
SCHEMBL4849535 0.81 CHRNB2 (0.40) CHRNB2CHRNA4LMNAKMT2ACCNC
SCHEMBL6322132 0.81 MKNK1 (0.35) CHRNB2CHRNA4L3MBTL1ALDH1A1KDM4E
SCHEMBL2270306 0.79 ALDH1A1 (0.43) CHRNB2CHRNA4LMNAKMT2AALDH1A1
SCHEMBL8131766 0.79 ALDH1A1 (0.41) CHRNB2CHRNA4LMNAKMT2AALDH1A1
SCHEMBL1808632 0.78 TBXAS1 (0.35) CHRNB2CHRNA4LMNAL3MBTL1ALDH1A1
SCHEMBL2112250 0.78 CHRNB2 (0.33) CHRNB2CHRNA4LMNAALDH1A1TDP1
SCHEMBL13712395 0.77 F7 (0.39) CHRNB2CHRNA4LMNAKMT2AALDH1A1
SCHEMBL18855242 0.77 KMT2A (0.37) LMNAKMT2AALDH1A1KDM4ENPC1
SCHEMBL4475691 0.77 SMN1; SMN2 (0.37) CHRNB2CHRNA4LMNAKMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230072867-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2023-03-09 US disclosed
US-11370774-B2 Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2022-06-28 US disclosed
US-20210221786-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2021-07-22 US disclosed
US-10829485-B2 ATF6 inhibitors and uses thereof BLACK BELT TX LTD (GB) 2020-11-10 US disclosed
EP-2655374-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS Incyte Corporation (US) 2013-10-30 EP disclosed
WO-2012087881-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2012-06-28 WO disclosed
US-20100305113-A1 Substituted Imidazopyridazines as Lipid Kinase Inhibitors CAPRARO HANS-GEORG 2010-12-02 US disclosed
EP-2155753-A1 SUBSTITUTED IMIDAZOPYRIDAZINES AS PI3K LIPID KINASE INHIBITORS Novartis Ag (CH) 2010-02-24 EP disclosed
WO-2008138834-A1 SUBSTITUTED IMIDAZOPYRIDAZINES AS PI3K LIPID KINASE INHIBITORS NOVARTIS AG (CH) 2008-11-20 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 (5 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-20230072867-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS C9, C5, C1QBP CHRNB2 4744/4885CHRNA4 4812/4885LMNA 2763/4885
US-10829485-B2 ATF6 inhibitors and uses thereof ATF4, XBP1, ATF1 CHRNB2 4487/4885CHRNA4 4573/4885LMNA 2920/4885
US-20100305113-A1 Substituted Imidazopyridazines as Lipid Kinase Inhibitors PI4KA, PIK3CA, PIK3CB CHRNB2 4822/4885CHRNA4 4654/4885LMNA 3806/4885
US-11370774-B2 Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors C9, C5, C1QBP CHRNB2 4744/4885CHRNA4 4812/4885LMNA 2763/4885
US-20210221786-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS C9, C5, C1QBP CHRNB2 4744/4885CHRNA4 4812/4885LMNA 2763/4885

“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.