SCHEMBL19023830

SCHEMBL19023830

CS(=O)(=O)C[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 0.46
RECQL P46063 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
S1PR1 P21453 1/20 0.44
S1PR5 Q9H228 1/20 0.44
MEN1 O00255 1/20 0.43
CYP2D6 P10635 1/20 0.43
KMT2A Q03164 1/20 0.43
HTR2A P28223 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
ACHE P22303 1/20 0.42
DRD2 P14416 1/20 0.42
PTPN1 P18031 1/20 0.42
ALDH1A1 P00352 1/20 0.41
MC4R P32245 1/20 0.41

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
SCHEMBL20875293 1.00 FUCA1 (0.46) FUCA1RECQLSMN1; SMN2S1PR1S1PR5
SCHEMBL19023831 1.00 FUCA1 (0.46) FUCA1RECQLSMN1; SMN2S1PR1S1PR5
SCHEMBL12723223 0.85 FUCA1 (0.53) FUCA1S1PR1S1PR5SIGMAR1ACHE
SCHEMBL25933663 0.85 FUCA1 (0.53) FUCA1S1PR1S1PR5SIGMAR1ACHE
SCHEMBL3226519 0.85 RECQL (0.49) FUCA1RECQLSMN1; SMN2MEN1CYP2D6
SCHEMBL3917960 0.81 FUCA1 (0.43) FUCA1RECQLSMN1; SMN2S1PR1S1PR5
SCHEMBL4889413 0.81 FUCA1 (0.43) FUCA1RECQLSMN1; SMN2S1PR1S1PR5
SCHEMBL19024339 0.81 FUCA1 (0.43) FUCA1RECQLSMN1; SMN2S1PR1S1PR5
SCHEMBL17220043 0.81 FUCA1 (0.43) FUCA1RECQLSMN1; SMN2S1PR1S1PR5
SCHEMBL3917962 0.81 FUCA1 (0.43) FUCA1RECQLSMN1; SMN2S1PR1S1PR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11634410-B2 Substituted 3-azabicyclo[3.1.0]hexanes as ketohexokinase inhibitors PFIZER INC. (US) 2023-04-25 US disclosed
US-20210309644-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS PFIZER INC. (US) 2021-10-07 US disclosed
US-10988463-B2 Substituted 3-azabicyclo[3.1.0]hexanes as ketohexokinase inhibitors PFIZER INC. (US) 2021-04-27 US disclosed
EP-3397631-B1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS PFIZER (US) 2021-04-07 EP disclosed
US-20200377482-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS PFIZER INC. (US) 2020-12-03 US disclosed
US-10787438-B2 Substituted 3-azabicyclo[3.1.0]hexanes as ketohexokinase inhibitors PFIZER INC. (US) 2020-09-29 US disclosed
US-20200148669-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS PFIZER INC. (US) 2020-05-14 US disclosed
US-20190106412-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS PFIZER INC. (US) 2019-04-11 US disclosed
US-10174007-B2 Substituted 3-azabicyclo[3.1.0]hexanes as ketohexokinase inhibitors PFIZER INC. (US) 2019-01-08 US disclosed
EP-3397631-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS Pfizer Inc (US) 2018-11-07 EP disclosed
US-20180037575-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS PFIZER INC. 2018-02-08 US disclosed
US-9809579-B2 Substituted 3-azabicyclo[3.1.0]hexanes as ketohexokinase inhibitors PFIZER INC. (US) 2017-11-07 US disclosed
WO-2017115205-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS PFIZER INC. (US) 2017-07-06 WO disclosed
US-20170183328-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS PFIZER INC. 2017-06-29 US disclosed
US-9156791-B2 Pyrazole compounds acting against allergic, immune and inflammatory conditions GLAXO GROUP LIMITED (GB) 2015-10-13 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 (10 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-20200148669-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS HK1, GCK, KHK FUCA1 1552/4885RECQL 4745/4885SMN1; SMN2 4391/4885
US-20210309644-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS HK1, GCK, KHK FUCA1 1552/4885RECQL 4745/4885SMN1; SMN2 4391/4885
US-11634410-B2 Substituted 3-azabicyclo[3.1.0]hexanes as ketohexokinase inhibitors HK1, GCK, KHK FUCA1 1552/4885RECQL 4745/4885SMN1; SMN2 4391/4885
US-10988463-B2 Substituted 3-azabicyclo[3.1.0]hexanes as ketohexokinase inhibitors HK1, GCK, KHK FUCA1 1552/4885RECQL 4745/4885SMN1; SMN2 4391/4885
US-20170183328-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS HK1, GCK, KHK FUCA1 1552/4885RECQL 4745/4885SMN1; SMN2 4391/4885
US-20190106412-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS HK1, GCK, KHK FUCA1 1552/4885RECQL 4745/4885SMN1; SMN2 4391/4885
US-20200377482-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS HK1, GCK, KHK FUCA1 1552/4885RECQL 4745/4885SMN1; SMN2 4391/4885
US-20180037575-A1 SUBSTITUTED 3-AZABICYCLO[3.1.0]HEXANES AS KETOHEXOKINASE INHIBITORS HK1, GCK, KHK FUCA1 1552/4885RECQL 4745/4885SMN1; SMN2 4391/4885
US-10174007-B2 Substituted 3-azabicyclo[3.1.0]hexanes as ketohexokinase inhibitors HK1, GCK, KHK FUCA1 1552/4885RECQL 4745/4885SMN1; SMN2 4391/4885
US-10787438-B2 Substituted 3-azabicyclo[3.1.0]hexanes as ketohexokinase inhibitors HK1, GCK, KHK FUCA1 1552/4885RECQL 4745/4885SMN1; SMN2 4391/4885

“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.