SCHEMBL3836788

SCHEMBL3836788

COc1ccc(CCCCC=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.55
IGF1R P08069 1/20 0.53
ALOX15 P16050 1/20 0.53
ALOX5 P09917 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA5A P35218 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
F2RL1 P55085 1/20 0.47
MAOB P27338 1/20 0.46

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
SCHEMBL27241091 0.98 CALM1 (0.53) CALM1IGF1RALOX15ALOX5TAAR1
SCHEMBL11044754 0.98 CALM1 (0.53) CALM1IGF1RALOX15ALOX5TAAR1
SCHEMBL1272900 0.94 CALM1 (0.56) CALM1IGF1RALOX15ALOX5TAAR1
Hydrochloric Acid SCHEMBL6614288 0.93 CALM1 (0.55) CALM1IGF1RALOX15ALOX5TAAR1
SCHEMBL911097 0.86 TAAR1 (0.55) CALM1ALOX15TAAR1CA12CA1
SCHEMBL4254058 0.84 CALM1 (0.72) CALM1IGF1RALOX15ALOX5TAAR1
SCHEMBL8196325 0.82 CHRM2 (0.53) CALM1IGF1RALOX15CA12CA1
SCHEMBL12549249 0.82 NQO1 (0.48) L3MBTL1
SCHEMBL17400406 0.82 CALM1 (0.69) CALM1IGF1RALOX15ALOX5TAAR1
SCHEMBL11007798 0.82 CALM1 (0.69) CALM1IGF1RALOX15ALOX5TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119118910-A Compounds for specific labelling of Tau proteins 北京师范大学 2024-12-13 CN disclosed
US-12030835-B2 Substituted amide compounds useful as farnesoid X receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-09 US disclosed
US-20220213026-A1 SUBSTITUTED AMIDE COMPOUNDS USEFUL AS FARNESOID X RECEPTOR MODULATORS BRISTOL MYERS SQUIBB CO (US) 2022-07-07 US disclosed
EP-1694619-B1 LIQUID-CRYSTAL COMPOSITIONS COMPRISING CHIRAL COMPOUNDS IND TECH RES INST (TW) 2009-10-14 EP disclosed
EP-1768943-B1 PROCESS FOR PREPARING ENANTIOMERICALLY PURE 1,1'-SPIROBIINDANE-6,6'-DIOL DERIVATIVES IND TECH RES INST (CN) 2008-12-17 EP disclosed
US-7214834-B2 Process for preparing enantiomerically pure 1,1′-spirobiindane-6,6′-diol derivatives EASTMAN KODAK COMPANY (US) 2007-05-08 US disclosed
US-7150900-B2 Liquid-crystal compositions comprising chiral compounds EASTMAN KODAK COMPANY (US) 2006-12-19 US disclosed
US-20060020150-A1 Process for preparing enantiomerically pure 1,1'-spirobiindane-6,6'-diol derivatives EASTMAN KODAK COMPANY 2006-01-26 US disclosed
US-20050127327-A1 Liquid-crystal compositions comprising chiral compounds EASTMAN KODAK COMPANY 2005-06-16 US disclosed
US-4345096-A 3-/P-OXYPHENYLALKYL/GLUTARIC ACID E. R. SQUIBB & SONS, INC. (US) 1982-08-17 US disclosed
US-4230621-A TRACERS, HYDROXYPHENYLGLUTARIC ACID DERIVATIVES E. R. SQUIBB & SONS, INC. (US) 1980-10-28 US disclosed
US-4221725-A CHEMICAL INTERMEDIATE E. R. SQUIBB & SONS, INC. (US) 1980-09-09 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 (3 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-20060020150-A1 Process for preparing enantiomerically pure 1,1'-spirobiindane-6,6'-diol derivatives HSD11B1, PKD1, REN CALM1 3546/4885IGF1R 3832/4885ALOX15 1117/4885
US-20220213026-A1 SUBSTITUTED AMIDE COMPOUNDS USEFUL AS FARNESOID X RECEPTOR MODULATORS FXR1, NR1H4, FXR2 CALM1 4011/4885IGF1R 1038/4885ALOX15 1073/4885
US-12030835-B2 Substituted amide compounds useful as farnesoid X receptor modulators FXR1, NR1H4, FXR2 CALM1 4011/4885IGF1R 1038/4885ALOX15 1073/4885

“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.