SCHEMBL3166464

SCHEMBL3166464

Cc1ncc(OC2CCCCO2)c(=O)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 3/20 0.36
▸ PDE4B Q07343 2/20 0.35
▸ DHFR P00374 1/20 0.33
▸ KDM4C Q9H3R0 1/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ TGFBR1 P36897 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ CPT1A P50416 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ GRM5 P41594 1/20 0.30
▸ PDE9A O76083 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
SCHEMBL9918615 0.84 PTPN1 (0.36) PTPN1PDE4BDHFRKDM4CNPC1
SCHEMBL14488316 0.83 PTPN1 (0.33) PTPN1PDE4BDHFRKDM4CMEN1
SCHEMBL16001134 0.78 MMP13 (0.49) NPC1RAB9AMEN1KMT2A
SCHEMBL14486051 0.77 KDM6B (0.49) PTPN1DHFRKDM4CNPC1RAB9A
SCHEMBL14485919 0.75 DAO (0.48) DHFRKDM4C
SCHEMBL14358192 0.75 TUBB4A (0.38) PDE4BKDM4CNPC1RAB9ATGFBR1
SCHEMBL14358188 0.75 TUBB4A (0.38) PDE4BKDM4CNPC1RAB9ATGFBR1
SCHEMBL14486125 0.75 DAO (0.50) DHFRKDM4CNPC1RAB9AMEN1
SCHEMBL9918614 0.75 PTPN1 (0.35) PTPN1PDE4BDHFRKDM4CGRM5
SCHEMBL14554707 0.74 DAO (0.52) PTPN1KDM4CRAB9APDE9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100008874-A1 SUBSTITUTED PYRIMIDINES, PROCESS FOR THEIR PRODUCTION AND THEIR USE AS EFFECTIVE ABSORBENTS OF UV IRRADIATION YISSUM RESEARCH DEVELOPMENT COMPANY (IL) 2010-01-14 — — US disclosed
US-20100008874-A1 SUBSTITUTED PYRIMIDINES, PROCESS FOR THEIR PRODUCTION AND THEIR USE AS EFFECTIVE ABSORBENTS OF UV IRRADIATION YISSUM RESEARCH DEVELOPMENT COMPANY (IL) 2010-01-14 — — US disclosed
WO-2007116412-A1 SUBSTITUTED PYRIMIDINES, PROCESS FOR THEIR PRODUCTION AND THEIR USE AS EFFECTIVE ABSORBENTS OF UV IRRADIATION HADASIT MEDICAL RESEARCH SERVICES & DEVELOPMENT LIMITED (IL) 2007-10-18 — — 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-20100008874-A1 SUBSTITUTED PYRIMIDINES, PROCESS FOR THEIR PRODUCTION AND THEIR USE AS EFFECTIVE ABSORBENTS OF UV IRRADIATION UNG, UMPS, TYMP PTPN1 4182/4885PDE4B 2389/4885DHFR 44/4885

“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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