SCHEMBL12277888

SCHEMBL12277888

Cc1cc2cc3ccc4c5cc6oc(C(F)(F)F)cc6cc5ccc4c3cc2o1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.38
▸ CYP1A1 P04798 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP1B1 Q16678 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ PIM1 P11309 1/20 0.34
▸ CSNK2A2 P19784 1/20 0.34
▸ CSNK2B P67870 1/20 0.34
▸ CSNK2A1 P68400 1/20 0.34
▸ CSNK2A3 Q8NEV1 1/20 0.34
▸ DYRK1A Q13627 1/20 0.33
▸ LMNA P02545 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
SCHEMBL12277944 0.94 EPHX2 (0.38) EPHX2CYP1A1CYP1A2CYP1B1KDM4E
SCHEMBL15888125 0.91 KDM4E (0.41) EPHX2KDM4EALDH1A1MAPTHPGD
SCHEMBL12278571 0.85 PIM1 (0.42) CYP1A1CYP1A2CYP1B1KDM4EALDH1A1
SCHEMBL12321280 0.84 ALDH1A1 (0.41) EPHX2CYP1B1KDM4EALDH1A1MAPT
SCHEMBL18177588 0.82 PIM1 (0.44) CYP1A1CYP1A2CYP1B1KDM4EALDH1A1
SCHEMBL12320551 0.81 KDM4E (0.44) EPHX2KDM4EALDH1A1MAPTHPGD
SCHEMBL12277922 0.78 DYRK1A (0.41) CYP1A1CYP1A2CYP1B1KDM4EALDH1A1
SCHEMBL12279173 0.76 ALDH1A1 (0.44) EPHX2CYP1A1CYP1A2CYP1B1KDM4E
SCHEMBL12279108 0.76 CYP1A2 (0.53) EPHX2CYP1A1CYP1A2CYP1B1KDM4E
SCHEMBL12277878 0.75 CYP3A4 (0.47) CYP1A1KDM4EHPGDPIM1CSNK2A2

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-8785915-B2 Compound for organic thin film transistor and organic thin film transistor using the same IDEMITSU KOSAN CO., LTD. (JP) 2014-07-22 — — US disclosed
US-20110210319-A1 COMPOUND FOR ORGANIC THIN FILM TRANSISTOR AND ORGANIC THIN FILM TRANSISTOR USING THE SAME COMPOUND FOR ORGANIC THIN FLIM TRANSISTOR AND ORGANIC THAN FLIM TRANSITOR USING THE SAME (JP) 2011-09-01 — — 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-20110210319-A1 COMPOUND FOR ORGANIC THIN FILM TRANSISTOR AND ORGANIC THIN FILM TRANSISTOR USING THE SAME OR10J3, TCF4, CTCF EPHX2 1532/4885CYP1A1 87/4885CYP1A2 386/4885

“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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