SCHEMBL753452

SCHEMBL753452

Cc1ccc(-p2c3ccccc3c3cc4c(cc32)c2ccccc2p4-c2ccc(C)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 1/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ KIF11 P52732 1/20 0.32
▸ ACHE P22303 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ ALOX12 P18054 1/20 0.32
▸ CYP2A6 P11509 2/20 0.31
▸ CYP1A2 P05177 2/20 0.31
▸ TDP1 Q9NUW8 2/20 0.31
▸ MAOB P27338 2/20 0.30
▸ TNKS O95271 1/20 0.30
▸ PARP1 P09874 1/20 0.30
▸ TNKS2 Q9H2K2 1/20 0.30
▸ PARP2 Q9UGN5 1/20 0.30
▸ CTSV O60911 1/20 0.30
▸ CTSL P07711 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ RAB9A P51151 1/20 0.30

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
SCHEMBL753503 0.84 KDM4E (0.30) CYP1A2HPGD
SCHEMBL753447 0.83 CYP2A6 (0.42) ACHELMNATSHRALOX12CYP2A6
SCHEMBL12841529 0.83 KIF11 (0.35) KIF11ACHELMNATSHRALOX12
SCHEMBL753460 0.80 CYP2A6 (0.39) TSHRCYP2A6CYP1A2TDP1HPGD
SCHEMBL13502052 0.76 KIF11 (0.38) KIF11ACHELMNATSHRALOX12
SCHEMBL18255250 0.73 ALDH1A1 (0.44) ACHECYP1A2TDP1MAOBCTSL
SCHEMBL16806220 0.73 HTR2A (0.44) ACHELMNACTSVCTSL
SCHEMBL14422428 0.73 CES2 (0.44) LMNACTSLHPGDRAB9A
SCHEMBL753643 0.73 MAPT (0.39) LMNAALOX12TDP1MAOBTNKS
SCHEMBL753651 0.71 — —

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-8138355-B2 Heteroacene derivative, tetrahaloterphenyl derivative, and processes for producing the same TOSOH CORPORATION (JP) 2012-03-20 — — US disclosed
US-20090261300-A1 HETEROACENE DERIVATIVE, TETRAHALOTERPHENYL DERIVATIVE, AND PROCESSES FOR PRODUCING THE SAME TOSOH CORPORATION (JP) 2009-10-22 — — 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 (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-20090261300-A1 HETEROACENE DERIVATIVE, TETRAHALOTERPHENYL DERIVATIVE, AND PROCESSES FOR PRODUCING THE SAME AS3MT, TERT, TEAD1 KEAP1 1377/4885NFE2L2 79/4885KIF11 4696/4885

“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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