SCHEMBL7986086

SCHEMBL7986086

CN(C)Cc1csc(-c2ccccc2)n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 1/20 0.54
SIGMAR1 Q99720 1/20 0.54
RAB9A P51151 4/20 0.53
NPC1 O15118 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
DRD2 P14416 2/20 0.53
DRD4 P21917 2/20 0.53
DRD3 P35462 2/20 0.53
HPGD P15428 2/20 0.52
LMNA P02545 2/20 0.51
ENPP2 Q13822 1/20 0.51
MAPT P10636 1/20 0.50
KDM4E B2RXH2 1/20 0.50
USP30 Q70CQ3 2/20 0.48
TP53 P04637 1/20 0.48
PKM P14618 1/20 0.48
TSHR P16473 1/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48

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
SCHEMBL29793497 0.82 ENPP2 (0.46) TMEM97SIGMAR1RAB9ANPC1SMN1; SMN2
SCHEMBL153338 0.80 HPGD (0.60) RAB9ANPC1SMN1; SMN2DRD2DRD4
Hydrochloric Acid SCHEMBL17261462 0.79 HPGD (0.59) RAB9ANPC1SMN1; SMN2DRD2DRD4
SCHEMBL29793676 0.77 ENPP2 (0.45) TMEM97SIGMAR1RAB9ANPC1SMN1; SMN2
SCHEMBL28410960 0.77 ENPP2 (0.45) TMEM97SIGMAR1RAB9ANPC1SMN1; SMN2
SCHEMBL10058003 0.77 LMNA (0.64) RAB9ANPC1SMN1; SMN2DRD2DRD4
SCHEMBL104385 0.77 DRD2 (0.57) RAB9ANPC1SMN1; SMN2DRD2DRD4
SCHEMBL590109 0.77 KDM4E (0.62) RAB9ANPC1SMN1; SMN2DRD2DRD4
SCHEMBL104951 0.77 KDM4E (0.58) RAB9ANPC1SMN1; SMN2DRD2DRD4
SCHEMBL2094508 0.77 DRD2 (0.57) RAB9ANPC1SMN1; SMN2DRD2DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11014912-B2 Cyanopyrrolidine derivatives with activity as inhibitors of USP30 MISSION THERAPEUTICS LIMITED (GB) 2021-05-25 US disclosed
EP-3519385-B1 CYANOPYRROLIDINE DERIVATIVES WITH ACTIVITY AS INHIBITORS OF USP30 MISSION THERAPEUTICS LTD (GB) 2020-11-18 EP disclosed
WO-2018060689-A1 CYANOPYRROLIDINE DERIVATIVES WITH ACTIVITY AS INHIBITORS OF USP30 MISSION THERAPEUTICS LIMITED (GB) 2018-04-05 WO disclosed
US-6281217-B2 ANTIFUNGAL ACTIVITY AGAINST A VARIETY OF FUNGI INCLUDING STRAINS WHICH HAVE PROVEN TO BE RESISTANT TO TREATMENT WITH KNOWN ANTIFUNGAL AGENTS SUCH AS FLUCONAZOLE. YU DINGWEI TIM (US) 2001-08-28 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 (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-11014912-B2 Cyanopyrrolidine derivatives with activity as inhibitors of USP30 USP30, USP39, USP28 TMEM97 879/4885SIGMAR1 2502/4885RAB9A 3387/4885

“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.