SCHEMBL6281523

SCHEMBL6281523

C=Cc1ccccc1C(C)C(C)c1ccccc1C=C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
TSHR P16473 4/20 0.35
GABRA1 P14867 2/20 0.34
GABRB2 P47870 2/20 0.34
HDAC8 Q9BY41 1/20 0.31
LMNA P02545 2/20 0.31
BLM P54132 2/20 0.31
CYP3A4 P08684 2/20 0.31
FAAH O00519 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CYP1A2 P05177 1/20 0.31
HPGD P15428 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
PTGS1 P23219 1/20 0.31
SLC6A2 P23975 1/20 0.31
HTR2C P28335 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31

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
SCHEMBL56243 0.86 GABRA1 (0.44) ALDH1A1TSHRGABRA1GABRB2LMNA
SCHEMBL50011 0.86 ALDH1A1 (0.44) ALDH1A1TSHRGABRA1GABRB2HDAC8
SCHEMBL29717597 0.86 GABRA1 (0.44) ALDH1A1TSHRGABRA1GABRB2LMNA
SCHEMBL29364896 0.86 ALDH1A1 (0.44) ALDH1A1TSHRGABRA1GABRB2HDAC8
SCHEMBL1507296 0.84 ALDH1A1 (0.48) ALDH1A1TSHRGABRA1GABRB2HDAC8
SCHEMBL5072506 0.84 ALDH1A1 (0.43) ALDH1A1TSHRGABRA1GABRB2HDAC8
SCHEMBL640982 0.84 ALDH1A1 (0.43) ALDH1A1TSHRGABRA1GABRB2LMNA
SCHEMBL1507290 0.82 ALDH1A1 (0.41) ALDH1A1TSHRGABRA1GABRB2CYP1A2
SCHEMBL2064114 0.82 ALDH1A1 (0.41) ALDH1A1TSHRGABRA1GABRB2
SCHEMBL9772094 0.82 ALDH1A1 (0.41) ALDH1A1TSHRGABRA1GABRB2

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-6855952-B2 Semiconductor device and semiconductor package HITACHI, LTD. (JP) 2005-02-15 US disclosed
US-20040102636-A1 Inhibition of p38 kinase using symmetrical and unsymmetrical diphenyl ureas BAYER CORPORATION 2004-05-27 US disclosed
US-20040038021-A1 Semiconductor device and semiconductor package HITACHI, LTD. (JP) 2004-02-26 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-20040102636-A1 Inhibition of p38 kinase using symmetrical and unsymmetrical diphenyl ureas MAP2K2, MAPK1, MAP2K1 ALDH1A1 1875/4885TSHR 3511/4885GABRA1 4563/4885

“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.