SCHEMBL14554479

SCHEMBL14554479

C=CCCCCOc1ccnc(-c2cc(OCCCCC=C)ccn2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 1/20 0.44
▸ CCR5 P51681 1/20 0.44
▸ CCR8 P51685 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ ALDH2 P05091 1/20 0.38
▸ MAOA P21397 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ CDK1 P06493 1/20 0.35
▸ CCNB1 P14635 1/20 0.35
▸ CCNA2 P20248 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ CCNA1 P78396 1/20 0.35
▸ PRSS1 P07477 4/20 0.33
▸ LSS P48449 2/20 0.33
▸ USP2 O75604 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ LPAR3 Q9UBY5 2/20 0.33
▸ LPAR2 Q9HBW0 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
SCHEMBL19392082 0.91 CCR1 (0.49) CCR1CCR5CCR8ALDH1A1L3MBTL1
SCHEMBL15906864 0.89 CCR1 (0.39) CCR1CCR5CCR8ALDH1A1L3MBTL1
SCHEMBL14554365 0.89 HDAC1 (0.39) CCR1CCR5CCR8ALDH1A1L3MBTL1
SCHEMBL17138168 0.78 KCNA3 (0.46) ALDH1A1L3MBTL1ALDH2MAOAMAOB
SCHEMBL2533057 0.78 CCR1 (0.50) CCR1CCR5CCR8ALDH1A1MAOA
SCHEMBL8553182 0.77 L3MBTL1 (0.61) ALDH1A1L3MBTL1ALDH2MAOAMAOB
SCHEMBL16581589 0.77 ALDH1A1 (0.47) ALDH1A1L3MBTL1ALDH2MAOAMAOB
SCHEMBL17138208 0.77 PRSS1 (0.46) ALDH1A1L3MBTL1ALDH2MAOAMAOB
SCHEMBL16581610 0.75 ALDH1A1 (0.46) ALDH1A1L3MBTL1ALDH2MAOAMAOB
SCHEMBL15365357 0.75 ALDH1A1 (0.59) ALDH1A1L3MBTL1ALDH2MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9683004-B2 Coated nanoparticles THE UNIVERSITY OF BIRMINGHAM (GB) 2017-06-20 — — US disclosed
US-9683004-B2 Coated nanoparticles THE UNIVERSITY OF BIRMINGHAM (GB) 2017-06-20 — — US disclosed
US-9683004-B2 Coated nanoparticles THE UNIVERSITY OF BIRMINGHAM (GB) 2017-06-20 — — US disclosed
US-20140212497-A1 COATED NANOPARTICLES THE UNIVERSITY OF BIRMINGHAM (GB) 2014-07-31 — — US disclosed
US-20140212497-A1 COATED NANOPARTICLES THE UNIVERSITY OF BIRMINGHAM (GB) 2014-07-31 — — US disclosed
US-20140212497-A1 COATED NANOPARTICLES THE UNIVERSITY OF BIRMINGHAM (GB) 2014-07-31 — — US disclosed
WO-2013004989-A1 COATED NANOPARTICLES THE UNIVERSITY OF BIRMINGHAM (GB) 2013-01-10 — — 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-20140212497-A1 COATED NANOPARTICLES CD63, PICALM, NCLN CCR1 3339/4885CCR5 3314/4885CCR8 3599/4885

“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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