SCHEMBL18370866

SCHEMBL18370866

c1ccc(-c2ncnc3sc4ccccc4c23)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 1/20 0.47
▸ LIMK1 P53667 4/20 0.41
▸ JAK2 O60674 2/20 0.39
▸ CDK5 Q00535 2/20 0.38
▸ CDK5R1 Q15078 1/20 0.38
▸ GPR3 P46089 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ FLT1 P17948 2/20 0.36
▸ KDR P35968 2/20 0.36
▸ DAPK3 O43293 1/20 0.36
▸ PRKD3 O94806 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
SCHEMBL25663345 0.88 KDR (0.46) ADORA2ALIMK1JAK2CDK5CDK5R1
SCHEMBL24795729 0.83 LIMK1 (0.37) LIMK1CDK5CDK5R1ALDH1A1KDM4E
SCHEMBL25841452 0.78 PRKD3 (0.39) LIMK1CDK5CDK5R1GPR3ALDH1A1
SCHEMBL18471422 0.78 KDM4E (0.39) ADORA2ALIMK1ALDH1A1KDM4EPOLB
SCHEMBL18803208 0.78 ELANE (0.40) ADORA2ALIMK1GPR3ALDH1A1KDM4E
SCHEMBL25461723 0.77 CYP2A6 (0.40) LIMK1CDK5CDK5R1GPR3ALDH1A1
SCHEMBL25663123 0.76 APP (0.50) ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL12903904 0.76 LIMK1 (0.40) LIMK1CDK5CDK5R1GPR3ALDH1A1
SCHEMBL924654 0.76 LIMK1 (0.56) LIMK1JAK2CDK5CDK5R1GPR3
SCHEMBL17109971 0.76 LIMK1 (0.40) LIMK1CDK5CDK5R1GPR3ALDH1A1

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-20220402877-A1 ELECTROLUMINESCENT DEVICE Beijing Summer Sprout Technology Co., Ltd. (CN) 2022-12-22 — — US disclosed
US-20220220049-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2022-07-14 — — US disclosed
US-20170012216-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2017-01-12 — — US disclosed
US-20170012216-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2017-01-12 — — 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-20220220049-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS HCN2, EPCAM, EFNA1 ADORA2A 17/4885LIMK1 612/4885JAK2 1732/4885
US-20220402877-A1 ELECTROLUMINESCENT DEVICE MCOLN2, MCOLN1, LDHB ADORA2A 4188/4885LIMK1 281/4885JAK2 4657/4885
US-20170012216-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 ADORA2A 4711/4885LIMK1 1263/4885JAK2 4321/4885

“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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