SCHEMBL19267562

SCHEMBL19267562

Cc1ccnc2sc3ccccc3c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 2/20 0.43
▸ ROCK1 Q13464 1/20 0.41
▸ GPR3 P46089 1/20 0.40
▸ MAPT P10636 3/20 0.39
▸ ABCG2 Q9UNQ0 1/20 0.39
▸ ELANE P08246 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.37
▸ CDK5 Q00535 1/20 0.37
▸ CDK5R1 Q15078 1/20 0.37
▸ L3MBTL1 Q9Y468 3/20 0.36
▸ POLB P06746 2/20 0.36
▸ HCRTR1 O43613 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ CYP2A6 P11509 1/20 0.36
▸ PSMD14 O00487 1/20 0.36
▸ COPS5 Q92905 1/20 0.36
▸ GRM1 Q13255 1/20 0.36
▸ TNKS O95271 1/20 0.36
▸ TNKS2 Q9H2K2 1/20 0.36
▸ MEN1 O00255 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
SCHEMBL24057409 0.79 AURKA (0.41) LIMK1ROCK1GPR3MAPTELANE
SCHEMBL17265873 0.79 GPR3 (0.40) LIMK1ROCK1GPR3MAPTELANE
SCHEMBL18177882 0.78 GPR3 (0.41) LIMK1ROCK1GPR3MAPTELANE
SCHEMBL25662803 0.77 LIMK1 (0.42) LIMK1ABCG2GRM1
SCHEMBL25711010 0.77 ROCK1 (0.38) LIMK1ROCK1GPR3MAPTELANE
SCHEMBL17109971 0.75 LIMK1 (0.40) LIMK1ROCK1GPR3MAPTELANE
SCHEMBL16919878 0.75 LIMK1 (0.42) LIMK1ALDH1A1L3MBTL1LMNACYP2A6
SCHEMBL13209223 0.75 LIMK1 (0.51) LIMK1ROCK1GPR3MAPTALDH1A1
SCHEMBL25751934 0.73 GPR3 (0.35) LIMK1ROCK1GPR3MAPTELANE
SCHEMBL22100018 0.73 GPR3 (0.46) ROCK1GPR3MAPTALDH1A1POLB

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-20230389413-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORPORATION 2023-11-30 — — US disclosed
US-20230389413-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORPORATION 2023-11-30 — — US disclosed
US-11758807-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION 2023-09-12 — — US disclosed
US-11758807-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION 2023-09-12 — — US disclosed
US-20230172057-A1 HETEROCYCLIC COMPOUND CONTAINING HETEROATOM SUBSTITUTED FLUORENE AND OPTOELECTRONIC DEVICE WUHAN TIANMA MICRO-ELECTRONICS CO., LTD. (CN) 2023-06-01 — — US disclosed
US-20210367162-A1 HETEROCYCLIC COMPOUND AND LIGHT-EMITTING DEVICE INCLUDING SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-11-25 — — US disclosed
US-20200274081-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORPORATION 2020-08-27 — — US disclosed
US-20180212158-A1 ORGANIC LIGHT-EMITTING DIODE MATERIALS PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2018-07-26 — — US disclosed
US-20170244049-A1 ORGANIC LIGHT-EMITTING DIODE MATERIALS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-08-24 — — 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-20230389413-A1 Organic Electroluminescent Materials and Devices GLRA3, ESRRG, GLRA1 LIMK1 2662/4885ROCK1 2718/4885GPR3 46/4885
US-20200274081-A1 Organic Electroluminescent Materials and Devices GLRA3, ESRRG, GLRA1 LIMK1 2662/4885ROCK1 2718/4885GPR3 46/4885
US-20230172057-A1 HETEROCYCLIC COMPOUND CONTAINING HETEROATOM SUBSTITUTED FLUORENE AND OPTOELECTRONIC DEVICE CHRM1, CHRM2, CHRM4 LIMK1 1044/4885ROCK1 1337/4885GPR3 274/4885
US-20180212158-A1 ORGANIC LIGHT-EMITTING DIODE MATERIALS MSN, DDT, NECTIN4 LIMK1 1250/4885ROCK1 4364/4885GPR3 2683/4885
US-20170244049-A1 ORGANIC LIGHT-EMITTING DIODE MATERIALS CYBA, DDT, DRD1 LIMK1 725/4885ROCK1 3982/4885GPR3 2975/4885
US-11758807-B2 Organic electroluminescent materials and devices GLRA3, ESRRG, GLRA1 LIMK1 2662/4885ROCK1 2718/4885GPR3 46/4885

“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.

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