SCHEMBL4384473

SCHEMBL4384473

CC1(C)OB(c2ccc(C3CCN(CC(F)(F)F)CC3)cc2)OC1(C)C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPL P06858 7/20 0.39
LIPG Q9Y5X9 7/20 0.39
TLR9 Q9NR96 2/20 0.38
TLR8 Q9NR97 2/20 0.38
TLR7 Q9NYK1 2/20 0.38
HIF1A Q16665 1/20 0.37
DRD2 P14416 3/20 0.37
F11 P03951 3/20 0.36
F2 P00734 2/20 0.36
PRSS1 P07477 2/20 0.36
PRSS2 P07478 2/20 0.36
PRSS3 P35030 2/20 0.36
KDM1A O60341 1/20 0.36

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
SCHEMBL15571988 0.94 LPL (0.38) LPLLIPGTLR9TLR8TLR7
SCHEMBL24504339 0.88 LPL (0.42) LPLLIPGHIF1AF11F2
SCHEMBL22290411 0.85 DRD2 (0.44) LPLLIPGTLR9TLR8TLR7
SCHEMBL14167751 0.84 LPL (0.45) LPLLIPGHIF1ADRD2F11
SCHEMBL22804541 0.83 DRD2 (0.43) LPLLIPGHIF1ADRD2
SCHEMBL23291582 0.82 LPL (0.42) LPLLIPGTLR9TLR8TLR7
SCHEMBL31223090 0.82 DRD2 (0.58) LPLLIPGDRD2
SCHEMBL22804954 0.81 SLC18A3 (0.41) LPLLIPGHIF1ADRD2F11
SCHEMBL15774976 0.81 SLC18A3 (0.55) LPLLIPGHIF1ADRD2F11
SCHEMBL15168175 0.79 TLR9 (0.38) TLR9TLR8TLR7DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024193691-A1 CONJUGATE OF ANTI-ROR1 ANTIBODY AND PBD COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 江苏恒瑞医药股份有限公司 2024-09-26 WO disclosed
EP-2632551-B1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME (US) 2016-07-06 EP disclosed
US-8895583-B2 Soluble guanylate cyclase activators MERCK SHARP & DOHME CORP. (US) 2014-11-25 US disclosed
US-8895583-B2 Soluble guanylate cyclase activators MERCK SHARP & DOHME CORP. (US) 2014-11-25 US disclosed
US-20130210798-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME LLC 2013-08-15 US disclosed
US-20130210798-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME LLC 2013-08-15 US disclosed
WO-2012058132-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME CORP. (US) 2012-05-03 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-20130210798-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS GUCY1B1, GUCY1A1, GUCY1A2 LPL 773/4885LIPG 80/4885TLR9 1357/4885

“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.