SCHEMBL5945342

SCHEMBL5945342

C=CCC(C=CC)CCCCCCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.40
ALDH1A1 P00352 1/20 0.33
FAAH O00519 1/20 0.33
LMNA P02545 1/20 0.33
ADH1B P00325 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 1/20 0.32
ADH4 P08319 1/20 0.32
ADH7 P40394 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
DNM1 Q05193 2/20 0.32
SMPD1 P17405 3/20 0.32
FFAR4 Q5NUL3 1/20 0.32
TRPA1 O75762 1/20 0.32
DDAH1 O94760 1/20 0.32
GAPDH P04406 1/20 0.32
MAPT P10636 1/20 0.32
FFAR1 O14842 1/20 0.32
OPRM1 P35372 1/20 0.31
PLA2G2C Q5R387 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
SCHEMBL9717978 0.92 TSHR (0.39) TSHRALDH1A1SMN1; SMN2DNM1
SCHEMBL9717975 0.92 TSHR (0.39) TSHRALDH1A1SMN1; SMN2DNM1
SCHEMBL8899772 0.84 TSHR (0.43) TSHRALDH1A1FAAHLMNAADH1B
SCHEMBL10467297 0.81 TSHR (0.41) TSHRLMNAADH1BADH1CADH1A
SCHEMBL8755967 0.81 TSHR (0.41) TSHRLMNAADH1BADH1CADH1A
SCHEMBL11973211 0.79 TSHR (0.46) TSHRALDH1A1LMNAADH1BADH1C
SCHEMBL11973209 0.79 TSHR (0.46) TSHRALDH1A1LMNAADH1BADH1C
SCHEMBL11972784 0.79 TSHR (0.46) TSHRALDH1A1LMNAADH1BADH1C
SCHEMBL1506833 0.79 TSHR (0.46) TSHRALDH1A1LMNAADH1BADH1C
SCHEMBL11972782 0.79 TSHR (0.46) TSHRALDH1A1LMNAADH1BADH1C

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060140886-A1 Tanning aids ROEHM GMBH & CO. KG (DE) 2006-06-29 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-20060140886-A1 Tanning aids TTPA, TMT1A, POT1 TSHR 3859/4885ALDH1A1 1018/4885FAAH 1750/4885

“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.