Thiophene

Thiophene

SCHEMBL5033248

c1cc2cccc3c4cccc5cccc(c(c1)c23)c54.c1ccc(N(c2ccccc2)c2ccccc2)cc1.c1ccsc1

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.43
▸ CYP1A2 P05177 5/20 0.43
▸ HSD17B10 Q99714 5/20 0.43
▸ HPGD P15428 3/20 0.43
▸ THRB P10828 1/20 0.43
▸ L3MBTL1 Q9Y468 4/20 0.36
▸ CYP3A4 P08684 3/20 0.36
▸ TDP1 Q9NUW8 3/20 0.36
▸ CYP2D6 P10635 2/20 0.36
▸ CYP2C9 P11712 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ ERBB2 P04626 1/20 0.36
▸ FYN P06241 1/20 0.36
▸ MAOA P21397 1/20 0.36
▸ ACHE P22303 1/20 0.36
▸ AHR P35869 1/20 0.36
▸ SIGMAR1 Q99720 3/20 0.34
▸ ALOX15 P16050 1/20 0.33

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
SCHEMBL27993390 0.88 ALDH1A1 (0.54) ALDH1A1CYP1A2HSD17B10HPGDTHRB
Thiophene SCHEMBL20518196 0.84 ALDH1A1 (0.52) ALDH1A1CYP1A2HSD17B10HPGDTHRB
Thiophene SCHEMBL1795888 0.84 ALDH1A1 (0.52) ALDH1A1CYP1A2HSD17B10HPGDTHRB
Benzene SCHEMBL28232915 0.82 ALDH1A1 (0.50) ALDH1A1CYP1A2L3MBTL1CYP3A4TDP1
Thiophene SCHEMBL6014821 0.82 ALDH1A1 (0.50) ALDH1A1CYP1A2L3MBTL1CYP3A4TDP1
Pyrene SCHEMBL28096154 0.75 ALDH1A1 (0.58) ALDH1A1CYP1A2HSD17B10HPGDTHRB
SCHEMBL4026976 0.74 ALDH1A1 (0.43) ALDH1A1CYP1A2HSD17B10HPGDTHRB
Thiophene SCHEMBL28193362 0.74 ALDH1A1 (0.43) ALDH1A1CYP1A2HPGDL3MBTL1CYP3A4
SCHEMBL13899997 0.73 ALDH1A1 (0.42) ALDH1A1CYP1A2HSD17B10HPGDTHRB
SCHEMBL77377 0.73 CYP1A2 (0.40) ALDH1A1CYP1A2HSD17B10HPGDTHRB

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-20080283122-A1 Beta-Substituted Porphyrins CAMPBELL WAYNE MASON 2008-11-20 — — 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-20080283122-A1 Beta-Substituted Porphyrins PPOX, HMBS, CRY1 ALDH1A1 3338/4885CYP1A2 1828/4885HSD17B10 4364/4885

“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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