SCHEMBL9968576

SCHEMBL9968576

COc1cc(C(=O)Br)cc(OC)c1OC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TPMT P51580 1/20 0.58
▸ TUBB1 Q9H4B7 4/20 0.55
▸ TUBB4A P04350 3/20 0.55
▸ TUBB P07437 3/20 0.55
▸ TUBA3C P0DPH7 3/20 0.55
▸ TUBA1B P68363 3/20 0.55
▸ TUBA4A P68366 3/20 0.55
▸ TUBB4B P68371 3/20 0.55
▸ TUBB3 Q13509 3/20 0.55
▸ TUBB2A Q13885 3/20 0.55
▸ TUBB8 Q3ZCM7 3/20 0.55
▸ TUBA3E Q6PEY2 3/20 0.55
▸ TUBA1A Q71U36 3/20 0.55
▸ TUBA1C Q9BQE3 3/20 0.55
▸ TUBB6 Q9BUF5 3/20 0.55
▸ TUBB2B Q9BVA1 3/20 0.55
▸ HTT P42858 2/20 0.55
▸ TSHR P16473 1/20 0.55
▸ APOBEC3A P31941 1/20 0.55
▸ APOBEC3G Q9HC16 1/20 0.55

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
SCHEMBL4625442 0.82 TUBB1 (0.58) TPMTTUBB1TUBB4ATUBBTUBA3C
SCHEMBL4819729 0.82 TUBB4A (0.75) TUBB1TUBB4ATUBBTUBA3CTUBA1B
3,4,5-Trimethoxybenzoic Acid SCHEMBL6592 0.80 TPMT (0.78) TPMTTUBB1TUBB4ATUBBTUBA3C
SCHEMBL4089388 0.80 TUBB4A (0.56) TPMTTUBB1TUBB4ATUBBTUBA3C
Hydrochloric Acid SCHEMBL27888195 0.80 TUBB4A (0.72) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL290542 0.80 LMNA (0.69) TPMTTUBB1TUBB4ATUBBTUBA3C
SCHEMBL7670701 0.78 TUBB4A (0.55) TPMTTUBB1TUBB4ATUBBTUBA3C
3,4,5-Trimethoxybenzoic Acid SCHEMBL11023602 0.78 TPMT (0.75) TPMTTUBB1TUBB4ATUBBTUBA3C
3,4,5-Trimethoxybenzoic Acid SCHEMBL10838612 0.78 TPMT (0.75) TPMTTUBB1TUBB4ATUBBTUBA3C
3,4,5-Trimethoxybenzoic Acid SCHEMBL9739818 0.78 TPMT (0.75) TPMTTUBB1TUBB4ATUBBTUBA3C

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10882852-B1 3-vinylquinolines as cancer cells inhibitors KING ABDULAZIZ UNIVERSITY (SA) 2021-01-05 — — US disclosed
US-9519216-B2 Positive photosensitive resin compositions FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2016-12-13 — — US disclosed
US-9519216-B2 Positive photosensitive resin compositions FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2016-12-13 — — US disclosed
US-8293898-B2 Luminophores UNIVERSITY OF YORK (GB) 2012-10-23 — — US disclosed
US-8293898-B2 Luminophores UNIVERSITY OF YORK (GB) 2012-10-23 — — US disclosed
US-20120157681-A1 LUMINOPHORES UNIVERSITY OF YORK (GB) 2012-06-21 — — US disclosed
US-20120157681-A1 LUMINOPHORES UNIVERSITY OF YORK (GB) 2012-06-21 — — US disclosed
US-7803510-B2 Positive photosensitive polybenzoxazole precursor compositions FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2010-09-28 — — US disclosed
US-7803510-B2 Positive photosensitive polybenzoxazole precursor compositions FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2010-09-28 — — US disclosed
US-20090197067-A1 Novel Positive Photosensitive Resin Compositions FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2009-08-06 — — US disclosed
US-20090004444-A1 Novel Photosensitive Resin Compositions FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2009-01-01 — — US disclosed
US-7416830-B2 Photosensitive resin compositions FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2008-08-26 — — US disclosed
US-7416830-B2 Photosensitive resin compositions FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2008-08-26 — — US disclosed
US-7407731-B2 of photosensitive polybenzoxazole (PBO) precursors, a mercapto compound of given formula such as 2-mercaptobenzoxazole to inhibit residue from forming, a photosensitive agent, a photoactive compound and solvent; electronics, relief images FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2008-08-05 — — US disclosed
US-7407731-B2 of photosensitive polybenzoxazole (PBO) precursors, a mercapto compound of given formula such as 2-mercaptobenzoxazole to inhibit residue from forming, a photosensitive agent, a photoactive compound and solvent; electronics, relief images FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2008-08-05 — — US disclosed
US-7220520-B2 Photosensitive resin compositions FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2007-05-22 — — US disclosed
US-7220520-B2 Photosensitive resin compositions FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2007-05-22 — — US disclosed
US-20070099111-A1 Novel positive photosensitive polybenzoxazole precursor compositions FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. 2007-05-03 — — US disclosed
US-20070099111-A1 Novel positive photosensitive polybenzoxazole precursor compositions FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. 2007-05-03 — — US disclosed
WO-2007022124-A2 NOVEL POSITIVE PHOTOSENSITIVE POLYBENZOXAZOLE PRECURSOR COMPOSITIONS FUJIFILM ELECTRONIC MATERIALS U.S.A, INC. (US) 2007-02-22 — — 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 (2 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-20120157681-A1 LUMINOPHORES PPOX, CRY1, MPO TPMT 1035/4885TUBB1 344/4885TUBB4A 362/4885
US-10882852-B1 3-vinylquinolines as cancer cells inhibitors MCL1, VHL, API5 TPMT 2406/4885TUBB1 927/4885TUBB4A 944/4885

“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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