SCHEMBL2425555

SCHEMBL2425555

C=CCc1ccc2cc(Br)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.47
ALDH1A1 P00352 6/20 0.46
MAPT P10636 5/20 0.46
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
GABRA1 P14867 4/20 0.46
GABRB2 P47870 4/20 0.46
KDM4E B2RXH2 3/20 0.46
GAA P10253 3/20 0.46
CNR2 P34972 3/20 0.46
PPARG P37231 2/20 0.46
PPARD Q03181 2/20 0.46
CNR1 P21554 2/20 0.46
ALDH2 P05091 1/20 0.46
AKR1B1 P15121 1/20 0.46
HPGD P15428 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CYP2A6 P11509 1/20 0.45
PPARA Q07869 1/20 0.43
CYP3A4 P08684 3/20 0.42

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
SCHEMBL3259762 0.87 XDH (0.58) XDHALDH1A1MAPTMEN1KMT2A
SCHEMBL11494827 0.83 XDH (0.54) XDHALDH1A1MAPTMEN1KMT2A
SCHEMBL7055734 0.83 XDH (0.54) XDHALDH1A1MAPTMEN1KMT2A
SCHEMBL7043823 0.83 XDH (0.54) XDHALDH1A1MAPTMEN1KMT2A
SCHEMBL198193 0.83 XDH (0.54) XDHALDH1A1MAPTMEN1KMT2A
SCHEMBL253471 0.83 XDH (0.54) XDHALDH1A1MAPTMEN1KMT2A
SCHEMBL525153 0.82 CYP2A6 (0.46) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL7555913 0.81 XDH (0.56) XDHALDH1A1MAPTMEN1KMT2A
SCHEMBL31195248 0.79 CYP1A2 (0.54) XDHALDH1A1MAPTMEN1KMT2A
SCHEMBL621971 0.79 CYP1A2 (0.54) XDHALDH1A1MAPTMEN1KMT2A

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-8901540-B2 Fused ring compounds useful in organic thin-film transistors IDEMITSU KOSAN CO., LTD. (JP) 2014-12-02 US disclosed
US-8872163-B2 2014-10-28 US disclosed
US-20110220884-A1 COMPOUND FOR ORGANIC THIN-FILM TRANSISTOR AND ORGANIC THIN-FILM TRANSISTOR USING SAME USHIO CHEMIX CORPORATION (JP) 2011-09-15 US disclosed
CN-102137830-A Compound for organic thin film transistor and organic thin film transistor using the same IDEMITSU KOSAN CO 2011-07-27 CN 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-20110220884-A1 COMPOUND FOR ORGANIC THIN-FILM TRANSISTOR AND ORGANIC THIN-FILM TRANSISTOR USING SAME TTI1, TCF4, RCOR1 XDH 2134/4885ALDH1A1 952/4885MAPT 296/4885

“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.