Sugi Predict

Sugi Predict / Compounds / SCHEMBL18668485

SCHEMBL18668485

SCHEMBL18668485

Brc1ccc2c(c1)c1ccccc1c1[nH]c3ccccc3c21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 5/20 0.55
▸ CCND1 P24385 5/20 0.55
▸ CDK5 Q00535 4/20 0.55
▸ CDK5R1 Q15078 4/20 0.55
▸ CCNB2 O95067 3/20 0.55
▸ CCNE2 O96020 3/20 0.55
▸ CDK1 P06493 3/20 0.55
▸ CCNB1 P14635 3/20 0.55
▸ CCNE1 P24864 3/20 0.55
▸ CDK2 P24941 3/20 0.55
▸ CCNB3 Q8WWL7 3/20 0.55
▸ CAMK2B Q13554 3/20 0.55
▸ CAMK2G Q13555 3/20 0.55
▸ CAMK2D Q13557 3/20 0.55
▸ CAMK2A Q9UQM7 3/20 0.55
▸ CCNA2 P20248 2/20 0.55
▸ CCNT1 O60563 1/20 0.55
▸ EIF2AK2 P19525 1/20 0.55
▸ CDK9 P50750 1/20 0.55
▸ GABRP O00591 2/20 0.54

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
SCHEMBL12003777 0.90 AR (0.58) CDK4CCND1CDK5CDK5R1CCNB2
SCHEMBL1899929 0.90 CDK4 (0.57) CDK4CCND1CDK5CDK5R1CCNB2
SCHEMBL29385634 0.84 GABRP (0.67) CDK4CCND1CDK5CDK5R1CCNB2
SCHEMBL31677103 0.84 GABRP (0.67) CDK4CCND1CDK5CDK5R1CCNB2
SCHEMBL532386 0.84 GABRP (0.67) CDK4CCND1CDK5CDK5R1CCNB2
SCHEMBL29831925 0.84 GABRP (0.67) CDK4CCND1CDK5CDK5R1CCNB2
Ammonia Solution, Strong SCHEMBL28374490 0.82 GABRP (0.64) CDK4CCND1CDK5CDK5R1CCNB2
SCHEMBL18435754 0.82 GABRP (0.70) CDK4CCND1CDK5CDK5R1CCNB2
SCHEMBL30324458 0.82 GABRP (0.70) CDK4CCND1CDK5CDK5R1CCNB2
SCHEMBL26543398 0.81 CDK4 (0.56) CDK4CCND1CDK5CDK5R1CCNB2

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-10840457-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2020-11-17 — — US disclosed
US-20180269405-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2018-09-20 — — US disclosed
WO-2017052099-A1 COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2017-03-30 — — WO disclosed
WO-2017052099-A1 COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2017-03-30 — — WO 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 (2 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-10840457-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof PIEZO1, OR10J3, OCIAD1 CDK4 2164/4885CCND1 835/4885CDK5 3929/4885
US-20180269405-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF PIEZO1, OR10J3, OCIAD1 CDK4 2164/4885CCND1 835/4885CDK5 3929/4885

“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.