SCHEMBL22299792

SCHEMBL22299792

Brc1csc(-c2ccncc2)c1-c1ccncc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.56
MAPT P10636 3/20 0.56
CYP1A2 P05177 2/20 0.56
CYP3A4 P08684 2/20 0.56
CYP2D6 P10635 2/20 0.56
CYP2C9 P11712 2/20 0.56
CYP2C19 P33261 2/20 0.56
POLB P06746 1/20 0.42
LMNA P02545 2/20 0.42
MAPK14 Q16539 4/20 0.40
RAB9A P51151 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NOTUM Q6P988 1/20 0.36
CYP19A1 P11511 1/20 0.35
NQO2 P16083 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA2B P29275 1/20 0.35
NPC1 O15118 3/20 0.34
AR P10275 2/20 0.34
GFER P55789 1/20 0.32

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
SCHEMBL22299324 0.80 ALDH1A1 (0.39) KDM4EMAPTLMNAMAPK14RAB9A
SCHEMBL15150098 0.72 KDM4E (1.00) KDM4EMAPTCYP1A2CYP3A4CYP2D6
SCHEMBL4302102 0.69 MAPT (0.71) KDM4EMAPTCYP1A2CYP3A4CYP2D6
SCHEMBL17552123 0.69 MAPK14 (0.53) KDM4EMAPTCYP1A2CYP3A4CYP2D6
SCHEMBL17542494 0.69 MAPK14 (0.53) KDM4EMAPTCYP1A2CYP3A4CYP2D6
SCHEMBL12902949 0.66 MAPT (0.56) KDM4EMAPTCYP1A2CYP3A4CYP2D6
SCHEMBL16376531 0.65 KDM4E (0.83) KDM4EMAPTCYP1A2CYP3A4CYP2D6
SCHEMBL13907344 0.65 MAPT (0.73) KDM4EMAPTCYP1A2CYP3A4CYP2D6
SCHEMBL9728 0.63 MAPT (1.00) KDM4EMAPTCYP1A2CYP3A4CYP2D6
SCHEMBL25463605 0.63 JAK2 (0.47) KDM4EMAPTCYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220098217-A1 COMPOUND, ORGANIC OPTOELECTRONIC ELEMENT, AND DISPLAY DEVICE LT MATERIALS CO., LTD. (KR) 2022-03-31 US disclosed
WO-2020159249-A1 COMPOSITION, ORGANIC OPTOELECTRONIC ELEMENT, AND DISPLAY DEVICE 엘티소재주식회사 2020-08-06 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 (1 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-20220098217-A1 COMPOUND, ORGANIC OPTOELECTRONIC ELEMENT, AND DISPLAY DEVICE AOX1, OXER1, OR51E2 KDM4E 3241/4885MAPT 2875/4885CYP1A2 203/4885

“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.