SCHEMBL17367222

SCHEMBL17367222

CC1(C)c2ccccc2-c2sc3ccccc3c21

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.35
HSP90AA1 P07900 1/20 0.35
PARP14 Q460N5 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
F9 P00740 1/20 0.33
ALOX5 P09917 1/20 0.33
ALDH1A1 P00352 1/20 0.33
NOTUM Q6P988 1/20 0.32
PGR P06401 1/20 0.32
MAPK3 P27361 1/20 0.31
MAPK1 P28482 1/20 0.31
MAP2K1 Q02750 1/20 0.31

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
SCHEMBL23593068 0.83 KDM4E (0.42) GPR3ALDH1A1PGR
SCHEMBL17012824 0.82 IDO1 (0.36) GPR3L3MBTL1CNR1CNR2ALDH1A1
SCHEMBL23593056 0.82 KDM4E (0.41) GPR3ALDH1A1PGR
SCHEMBL17533936 0.81 GPR3 (0.40) GPR3L3MBTL1HSP90AA1PARP14F9
SCHEMBL23593067 0.79 GPR3 (0.35) GPR3ALDH1A1
SCHEMBL23593061 0.79 SLC9A1 (0.39) GPR3L3MBTL1HSP90AA1PARP14ALDH1A1
SCHEMBL23592348 0.79 PDK2 (0.35) F9
SCHEMBL23593111 0.79 ALK (0.32) F9
SCHEMBL24036872 0.78 IDO1 (0.41) L3MBTL1ALDH1A1MAPK1
SCHEMBL17367224 0.78 PDE10A (0.30)

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-10749118-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-08-18 US disclosed
US-10370473-B2 Compound, curable composition, cured product, optical member, and lens FUJIFILM CORPORATION (JP) 2019-08-06 US disclosed
US-20150380663-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-31 US disclosed
US-20150380663-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-31 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 (3 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-10370473-B2 Compound, curable composition, cured product, optical member, and lens CRYZ, CRYAA, UACA GPR3 3594/4885L3MBTL1 1918/4885HSP90AA1 3837/4885
US-20150380663-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CYP1A1, CRY1, CYP1B1 GPR3 2488/4885L3MBTL1 717/4885HSP90AA1 4457/4885
US-10749118-B2 Heterocyclic compound and organic light-emitting device including the same CYP1A1, CRY1, CYP1B1 GPR3 2488/4885L3MBTL1 717/4885HSP90AA1 4457/4885

“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.