SCHEMBL4824062

SCHEMBL4824062

CSSc1nnc(SSC)s1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 2/20 0.43
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 2/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30
CA5A P35218 1/20 0.30
CA5B Q9Y2D0 1/20 0.30
APEX1 P27695 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
SCHEMBL20177136 0.97 FBP1 (0.48) FBP1KMT2AALDH1A1
SCHEMBL21897798 0.87 FBP1 (0.36) FBP1
SCHEMBL20177132 0.84
SCHEMBL4865603 0.83 FBP1 (0.42) FBP1KMT2AALDH1A1
SCHEMBL12313926 0.79 FBP1 (0.48) FBP1KMT2AALDH1A1CA1CA2
SCHEMBL5181029 0.73
SCHEMBL4821561 0.69 FBP1 (0.48) FBP1KMT2AALDH1A1CA1CA2
SCHEMBL17636797 0.68 FBP1 (0.38) FBP1CA1CA2CA4CA5A
SCHEMBL19311639 0.67 FBP1 (0.42) FBP1
SCHEMBL16187285 0.67 NPC1 (0.46) FBP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7396802-B2 Corrosion inhibitor/metal passivator additive composition from waste refinery streams INDIAN OIL CORPORATION LIMITED (IN) 2008-07-08 US claimed
US-20050032654-A1 Combination of 2,5-bis(alkyldithio)-1,3,4-thiadiazoles; low cost lubricant, grease and fuel additives; one pot, one step production using caustic wash of liquefied petroleum gas INDIAN OIL CORPORATION LIMITED (IN) 2005-02-10 US claimed
WO-2004011578-A1 CORROSION INHIBITOR/METAL PASSIVATOR ADDITIVE COMPOSITION FROM WASTE REFINERY STREAMS INDIAN OIL CORPORATION LIMITED (IN) 2004-02-05 WO claimed
US-20180142181-A1 Thiadiazole Components, Compositions, and Methods INTERNATIONAL PETROLEUM PRODUCTS & ADDITIVES COMPANY, INC. 2018-05-24 US disclosed
US-7396802-B2 Corrosion inhibitor/metal passivator additive composition from waste refinery streams INDIAN OIL CORPORATION LIMITED (IN) 2008-07-08 US disclosed
US-7396802-B2 Corrosion inhibitor/metal passivator additive composition from waste refinery streams INDIAN OIL CORPORATION LIMITED (IN) 2008-07-08 US disclosed
US-20050032654-A1 Combination of 2,5-bis(alkyldithio)-1,3,4-thiadiazoles; low cost lubricant, grease and fuel additives; one pot, one step production using caustic wash of liquefied petroleum gas INDIAN OIL CORPORATION LIMITED (IN) 2005-02-10 US disclosed
US-20050032654-A1 Combination of 2,5-bis(alkyldithio)-1,3,4-thiadiazoles; low cost lubricant, grease and fuel additives; one pot, one step production using caustic wash of liquefied petroleum gas INDIAN OIL CORPORATION LIMITED (IN) 2005-02-10 US disclosed
WO-2004011578-A1 CORROSION INHIBITOR/METAL PASSIVATOR ADDITIVE COMPOSITION FROM WASTE REFINERY STREAMS INDIAN OIL CORPORATION LIMITED (IN) 2004-02-05 WO disclosed
WO-2004011578-A1 CORROSION INHIBITOR/METAL PASSIVATOR ADDITIVE COMPOSITION FROM WASTE REFINERY STREAMS INDIAN OIL CORPORATION LIMITED (IN) 2004-02-05 WO 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-20050032654-A1 Combination of 2,5-bis(alkyldithio)-1,3,4-thiadiazoles; low cost lubricant, grease and fuel additives; one pot, one step production using caustic wash of liquefied petroleum gas GK, TPSD1, LTA4H FBP1 2161/4885KMT2A 3002/4885ALDH1A1 1248/4885

“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.