SCHEMBL10001341

SCHEMBL10001341

CC#CN(c1ccc(C)cc1)c1ccc(C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
TSHR P16473 1/20 0.46
ACHE P22303 4/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPT P10636 1/20 0.34
MCOLN3 Q8TDD5 1/20 0.34
CYP2C19 P33261 1/20 0.34
CYP2A6 P11509 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CHRNA7 P36544 1/20 0.31
HTR3E A5X5Y0 2/20 0.30
HTR3B O95264 2/20 0.30
HTR3A P46098 2/20 0.30
HTR3D Q70Z44 2/20 0.30
HTR3C Q8WXA8 2/20 0.30
TEAD4 Q15561 1/20 0.30
SLC22A2 O15244 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
SCHEMBL10001342 0.93 ALDH1A1 (0.41) ALDH1A1TSHRACHETDP1MAPT
SCHEMBL3087798 0.72 ALDH1A1 (0.48) ALDH1A1TSHRACHETDP1MAPT
SCHEMBL2140337 0.72 ALDH1A1 (0.48) ALDH1A1TSHRACHETDP1MAPT
SCHEMBL2926730 0.70 VCP (0.43) ALDH1A1TSHRACHEMAPTCYP2C19
SCHEMBL615437 0.66 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1MAPT
SCHEMBL7486403 0.66 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1MAPT
SCHEMBL6123161 0.66 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1MAPT
SCHEMBL16982395 0.66 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1MAPT
SCHEMBL12240222 0.66 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1MAPT
SCHEMBL76680 0.66 ALDH1A1 (0.61) ALDH1A1TSHRACHETDP1MAPT

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-8148519-B2 Porphyrin-based photosensitizer dyes for dye-sensitized solar cells NATIONAL CHIAO TUNG UNIVERSITY (TW) 2012-04-03 US disclosed
US-20100125136-A1 PORPHYRIN-BASED PHOTOSENSITIZER DYES FOR DYE-SENSITIZED SOLAR CELLS DC SOLAR CORP. A TAIWAN CORPORATION (TW) 2010-05-20 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-20100125136-A1 PORPHYRIN-BASED PHOTOSENSITIZER DYES FOR DYE-SENSITIZED SOLAR CELLS DNAH12, SLC39A3, CRY1 ALDH1A1 2030/4885TSHR 3928/4885ACHE 3730/4885

“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.