SCHEMBL6312469

SCHEMBL6312469

COc1ccc2cc(C3=CCNCC3)sc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 11/20 0.49
CYP1A2 P05177 3/20 0.49
CYP3A4 P08684 3/20 0.49
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
HTR1D P28221 1/20 0.49
HTR2C P28335 1/20 0.49
MAPK1 P28482 1/20 0.49
BRCA1 P38398 1/20 0.49
KMT2A Q03164 1/20 0.49
HSD17B10 Q99714 1/20 0.49
HTR7 P34969 3/20 0.48
CCNT1 O60563 3/20 0.43
CDK9 P50750 3/20 0.43
QDPR P09417 1/20 0.41
CA2 P00918 1/20 0.41
HTR1A P08908 3/20 0.39
DRD2 P14416 2/20 0.38

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
SCHEMBL5758301 0.80 HTR6 (0.44) HTR6HTR2CHTR7CCNT1CDK9
SCHEMBL7864911 0.80 SIGMAR1 (0.51) HTR6MAPTHTR2CHTR7CCNT1
SCHEMBL8599586 0.80 NPC1 (0.48) CYP1A2CYP3A4MEN1ALDH1A1MAPT
SCHEMBL7859769 0.79 HTR6 (0.37) HTR6HTR2CQDPR
SCHEMBL6836981 0.78 NPC1 (0.53) CYP1A2CYP3A4MEN1ALDH1A1MAPT
SCHEMBL4359750 0.77 SIGMAR1 (0.50) KDM4EALDH1A1MAPTHTR2CHSD17B10
SCHEMBL8600782 0.77 NPC1 (0.52) CYP1A2CYP3A4ALDH1A1MAPTCA2
SCHEMBL8601702 0.77 NPC1 (0.52) CYP1A2CYP3A4ALDH1A1MAPTCA2
SCHEMBL8600780 0.77 NPC1 (0.52) CYP1A2CYP3A4ALDH1A1MAPTCA2
SCHEMBL8601704 0.77 NPC1 (0.52) CYP1A2CYP3A4ALDH1A1MAPTCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119499181-A Bortezomib encapsulating agent, bortezomib liposome and preparation method 浙江海昶生物医药技术有限公司 2025-02-25 CN claimed
CN-119499181-A Bortezomib encapsulating agent, bortezomib liposome and preparation method 浙江海昶生物医药技术有限公司 2025-02-25 CN disclosed
CN-108359654-A A kind of mutant and its application with phospholipase B activity 江苏中酶生物科技有限公司 2018-08-03 CN disclosed
EP-3265063-A1 DUAL LOADED LIPOSOMAL PHARMACEUTICAL FORMULATIONS Cureport, Inc. (US) 2018-01-10 EP disclosed
US-20050123593-A1 Liposomal encapsulation of glycosaminoglycans for the treatment of arthritic joints THOMPSON JONATHAN (GB) 2005-06-09 US disclosed
US-6844344-B2 Benzofuran derivatives ELI LILLY AND COMPANY (US) 2005-01-18 US disclosed
US-20030232833-A1 Benzofuran derivatives ELI LILLY AND COMPANY 2003-12-18 US disclosed
WO-2003017978-A1 METHOD OF MANUFACTURING LIPOSOMES JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 2003-03-06 WO disclosed
US-20020119188-A1 Method of manufacturing liposomes JOHNSON & JOHNSON CONSUMER COMPANIES, INC. 2002-08-29 US disclosed
US-20020001613-A1 Method of manufacturing liposomes JOHNSON & JOHNSON CONSUMER COMPANIES, INC. 2002-01-03 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 (4 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-20020119188-A1 Method of manufacturing liposomes LIPA, CLPTM1L, MGLL HTR6 2652/4885CYP1A2 3944/4885CYP3A4 3678/4885
US-20030232833-A1 Benzofuran derivatives BRD1, BPTF, HTR1F HTR6 38/4885CYP1A2 162/4885CYP3A4 271/4885
US-20020001613-A1 Method of manufacturing liposomes LIPA, CLPTM1L, SGMS1 HTR6 3755/4885CYP1A2 4236/4885CYP3A4 3626/4885
US-20050123593-A1 Liposomal encapsulation of glycosaminoglycans for the treatment of arthritic joints CD44, LPCAT1, MMP7 HTR6 233/4885CYP1A2 3580/4885CYP3A4 4505/4885

“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.