SCHEMBL7954643

SCHEMBL7954643

O=S1(=O)N=C(NCCc2ccccn2)Nc2ccc(F)cc21

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.45
CYP1A2 P05177 1/20 0.41
HTT P42858 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
PDGFRB P09619 1/20 0.38
KIT P10721 1/20 0.38
KDR P35968 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
MAPK8 P45983 1/20 0.37
HTR2C P28335 1/20 0.37
HTR7 P34969 1/20 0.37
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
ALOX15 P16050 1/20 0.36
NAMPT P43490 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
SCHEMBL7953143 0.91 CYP1A2 (0.41) TAAR1CYP1A2HTTNPC1RAB9A
SCHEMBL7957206 0.89 TAAR1 (0.42) TAAR1NPC1RAB9AKDM4EALDH1A1
SCHEMBL7954628 0.88 PKM (0.48) TAAR1CYP1A2NPC1RAB9AKDM4E
SCHEMBL7952935 0.88 CYP1A2 (0.42) TAAR1CYP1A2NPC1RAB9AKDM4E
SCHEMBL7957415 0.83 PKM (0.43) TAAR1CYP1A2HTTNPC1RAB9A
SCHEMBL7952315 0.82 TAAR1 (0.50) TAAR1CYP1A2ALDH1A1LMNANAMPT
SCHEMBL7954571 0.82 CYP1A2 (0.40) TAAR1CYP1A2HTTNPC1RAB9A
SCHEMBL7954366 0.81 PKM (0.48) TAAR1CYP1A2NPC1RAB9AKDM4E
SCHEMBL24050978 0.80 TAAR1 (0.56) TAAR1NPC1RAB9AALDH1A1
SCHEMBL7951111 0.80 KMT2A (0.41) TAAR1NPC1RAB9AKDM4EALDH1A1

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-12209140-B2 Therapeutics for the treatment of glaucoma MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2025-01-28 US disclosed
US-20230101009-A1 THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2023-03-30 US disclosed
US-11505572-B2 Therapeutics for the treatment of glaucoma MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2022-11-22 US disclosed
US-10981951-B2 Therapeutics for the treatment of glaucoma MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2021-04-20 US disclosed
US-20210040148-A1 THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2021-02-11 US disclosed
US-20170002040-A1 NOVEL THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2017-01-05 US disclosed
EP-3099304-A1 NOVEL THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA Mayo Foundation for Medical Education and Research (US) 2016-12-07 EP disclosed
WO-2015117024-A1 NOVEL THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2015-08-06 WO disclosed
US-6242443-B1 1,2,4-benzothiadiazine derivatives, their preparation and use NOVO NORDISK AIS (DK) 2001-06-05 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 (6 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-20230101009-A1 THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA KCNJ1, KCNJ2, KCNJ11 TAAR1 2316/4885CYP1A2 2573/4885HTT 2552/4885
US-20210040148-A1 THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA KCNJ1, KCNJ2, KCNJ11 TAAR1 2316/4885CYP1A2 2573/4885HTT 2552/4885
US-12209140-B2 Therapeutics for the treatment of glaucoma KCNJ1, KCNJ2, KCNJ11 TAAR1 2316/4885CYP1A2 2573/4885HTT 2552/4885
US-20170002040-A1 NOVEL THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA KCNJ1, KCNK4, KCNK2 TAAR1 2278/4885CYP1A2 3097/4885HTT 2459/4885
US-11505572-B2 Therapeutics for the treatment of glaucoma KCNJ1, KCNJ2, KCNJ11 TAAR1 2316/4885CYP1A2 2573/4885HTT 2552/4885
US-10981951-B2 Therapeutics for the treatment of glaucoma KCNJ1, KCNJ2, KCNJ11 TAAR1 2316/4885CYP1A2 2573/4885HTT 2552/4885

“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.