SCHEMBL27014689

SCHEMBL27014689

Brc1ccc2c(ccc3[nH]c4cccc(Br)c4c32)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.39
METAP2 P50579 1/20 0.39
CSNK2A1 P68400 1/20 0.39
CYP19A1 P11511 1/20 0.38
PIM3 Q86V86 2/20 0.38
CDK4 P11802 7/20 0.38
CCND1 P24385 7/20 0.38
CCNE2 O96020 3/20 0.38
CCNE1 P24864 3/20 0.38
CDK2 P24941 3/20 0.38
CCNB2 O95067 2/20 0.38
CDK1 P06493 2/20 0.38
CCNB1 P14635 2/20 0.38
CCNB3 Q8WWL7 2/20 0.38
PRKACA P17612 1/20 0.38
PRKACG P22612 1/20 0.38
PRKACB P22694 1/20 0.38
CAMK2B Q13554 1/20 0.38
CAMK2G Q13555 1/20 0.38
CAMK2D Q13557 1/20 0.38

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
SCHEMBL31042711 0.88 METAP2 (0.47) NOS1METAP2CSNK2A1CYP19A1PIM3
SCHEMBL24549288 0.83 CDK4 (0.40) NOS1METAP2CSNK2A1PIM3CDK4
SCHEMBL16536115 0.82 CDK4 (0.55) CYP19A1PIM3CDK4CCND1CCNE2
SCHEMBL27014698 0.82 CDK4 (0.49) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL20065822 0.81 CDK4 (0.47) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL27014751 0.81 AR (0.43) PIM3CDK4CCND1CCNE2CCNE1
SCHEMBL30475432 0.80 CCNB2 (0.48) METAP2PIM3CDK4CCND1CCNE2
SCHEMBL17331160 0.80 CCNB2 (0.48) METAP2PIM3CDK4CCND1CCNE2
SCHEMBL29530429 0.80 GABRP (0.50) PIM3CDK4CCND1CCNE2CCNE1
SCHEMBL28474458 0.80 GABRP (0.50) PIM3CDK4CCND1CCNE2CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240074306-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, MANUFACTURING METHOD THEREFOR, AND COMPOSITION FOR ORGANIC LAYER LT MATERIALS CO., LTD. (KR) 2024-02-29 US disclosed
US-20240074306-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, MANUFACTURING METHOD THEREFOR, AND COMPOSITION FOR ORGANIC LAYER LT MATERIALS CO., LTD. (KR) 2024-02-29 US disclosed
US-20240023433-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME, MANUFACTURING METHOD OF THE SAME AND COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT-EMITTING DEVICE LT MATERIALS CO., LTD. (KR) 2024-01-18 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 (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-20240074306-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, MANUFACTURING METHOD THEREFOR, AND COMPOSITION FOR ORGANIC LAYER CYP1B1, NOTUM, WEE1 NOS1 149/4885METAP2 3684/4885CSNK2A1 2830/4885
US-20240023433-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME, MANUFACTURING METHOD OF THE SAME AND COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT-EMITTING DEVICE CYP1A1, CYP1B1, CYP2C9 NOS1 295/4885METAP2 3690/4885CSNK2A1 1976/4885

“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.