SCHEMBL13535008

SCHEMBL13535008

Ic1ccc(OCc2ccccc2)cn1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P4HTM Q9NXG6 1/20 0.60
▸ LMNA P02545 1/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ PTGS1 P23219 1/20 0.55
▸ SLC6A2 P23975 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ PTGS2 P35354 1/20 0.55
▸ SLC6A3 Q01959 1/20 0.55
▸ HIF1A Q16665 1/20 0.55
▸ HDAC6 Q9UBN7 1/20 0.55
▸ MAOB P27338 4/20 0.53
▸ APP P05067 2/20 0.53
▸ GAA P10253 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ MAOA P21397 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ ALOX5 P09917 1/20 0.52
▸ BCHE P06276 1/20 0.50

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
SCHEMBL18429639 0.85 APP (0.70) APPCYP3A4
SCHEMBL16846466 0.81 APP (0.66) MAOBAPPRAB9ASMN1; SMN2
SCHEMBL2307022 0.79 P4HTM (0.58) P4HTMLMNACYP1A2PTGS1SLC6A2
SCHEMBL30879831 0.79 P4HTM (0.58) P4HTMLMNACYP1A2PTGS1SLC6A2
SCHEMBL30362841 0.79 MAOB (0.61) P4HTMLMNACYP1A2PTGS1SLC6A2
SCHEMBL2648020 0.79 MAOB (0.61) P4HTMLMNACYP1A2PTGS1SLC6A2
SCHEMBL1103901 0.79 P4HTM (0.58) P4HTMLMNACYP1A2PTGS1SLC6A2
SCHEMBL113439 0.79 P4HTM (0.58) P4HTMLMNACYP1A2PTGS1SLC6A2
SCHEMBL228033 0.79 P4HTM (0.58) P4HTMLMNACYP1A2PTGS1SLC6A2
SCHEMBL940824 0.79 P4HTM (0.58) P4HTMLMNACYP1A2PTGS1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108541302-B Urea-based Prostate Specific Membrane Antigen (PSMA) inhibitors for imaging and therapy 五一一制药股份有限公司 2023-02-14 — — CN disclosed
EP-3397968-B1 UREA-BASED PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITORS FOR IMAGING AND THERAPY FIVE ELEVEN PHARMA INC (US) 2021-09-29 — — EP disclosed
US-10688200-B2 Urea-based prostate specific membrane antigen (PSMA) inhibitors for imaging and therapy FIVE ELEVEN PHARMA INC. (US) 2020-06-23 — — US disclosed
US-10688200-B2 Urea-based prostate specific membrane antigen (PSMA) inhibitors for imaging and therapy FIVE ELEVEN PHARMA INC. (US) 2020-06-23 — — US disclosed
WO-2017116994-A1 UREA-BASED PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITORS FOR IMAGING AND THERAPY FIVE ELEVEN PHARMA INC. (US) 2017-07-06 — — WO disclosed
US-20170189568-A1 UREA-BASED PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITORS FOR IMAGING AND THERAPY FIVE ELEVEN PHARMA INC. 2017-07-06 — — US disclosed
US-20170189568-A1 UREA-BASED PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITORS FOR IMAGING AND THERAPY FIVE ELEVEN PHARMA INC. 2017-07-06 — — US disclosed
US-7649015-B2 Cellular accumulation of phosphonate analogs of HIV protease inhibitor compounds GILEAD SCIENCES, INC. (US) 2010-01-19 — — US disclosed
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds GILEAD SCIENCES, INC. 2007-01-11 — — 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-20170189568-A1 UREA-BASED PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITORS FOR IMAGING AND THERAPY KLK3, FOLH1, UTS2R P4HTM 1247/4885LMNA 4549/4885CYP1A2 4729/4885
US-10688200-B2 Urea-based prostate specific membrane antigen (PSMA) inhibitors for imaging and therapy KLK3, FOLH1, UTS2R P4HTM 1247/4885LMNA 4549/4885CYP1A2 4729/4885
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds PPA1, PNP, PPME1 P4HTM 1571/4885LMNA 2720/4885CYP1A2 4360/4885

“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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