SCHEMBL18950244

SCHEMBL18950244

CC(C)c1cccc(CC(C)c2cccc(O)c2)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 5/20 0.47
▸ GABRA1 P14867 4/20 0.47
▸ LMNA P02545 4/20 0.47
▸ GABRB2 P47870 3/20 0.47
▸ TSHR P16473 3/20 0.47
▸ HTR2B P41595 2/20 0.47
▸ CYP1A2 P05177 2/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ BLM P54132 2/20 0.47
▸ GABRG2 P18507 2/20 0.47
▸ GABRB3 P28472 2/20 0.47
▸ FAAH O00519 1/20 0.47
▸ CA1 P00915 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ GABRB1 P18505 1/20 0.47
▸ PTGS1 P23219 1/20 0.47
▸ SLC6A2 P23975 1/20 0.47
▸ HTR2C P28335 1/20 0.47
▸ GABRA5 P31644 1/20 0.47

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
SCHEMBL19478609 0.86 GABRA1 (0.52) HIF1AGABRA1LMNAGABRB2TSHR
SCHEMBL19478530 0.80 GABRA1 (0.39) HIF1AGABRA1LMNAGABRB2TSHR
SCHEMBL27451548 0.80 HDAC4 (0.45) HIF1AGABRA1LMNAGABRB2TSHR
SCHEMBL7064844 0.77 GABRA1 (0.73) HIF1AGABRA1LMNAGABRB2TSHR
SCHEMBL13405958 0.74 GABRA1 (0.57) HIF1AGABRA1LMNAGABRB2TSHR
SCHEMBL9657114 0.73 GABRA1 (0.61) GABRA1GABRB2
SCHEMBL20368215 0.73 GABRA1 (0.47) HIF1AGABRA1LMNAGABRB2TSHR
SCHEMBL21734367 0.73 GABRA1 (0.67) HIF1AGABRA1LMNAGABRB2TSHR
SCHEMBL6396467 0.72 ADRB1 (0.39) HIF1ALMNATSHRHTR2BBLM
SCHEMBL4318572 0.72 GABRA1 (0.55) HIF1AGABRA1LMNAGABRB2TSHR

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-10202372-B2 Trisubstituted pyrido[2,3-D]pyrimidines, methods for preparing same and therapeutic uses thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S) (FR) 2019-02-12 — — US disclosed
US-9796694-B2 Modulation of bacterial quorum sensing with synthetic ligands WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2017-10-24 — — US disclosed
US-9676763-B2 Method of treating Ebola PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-06-13 — — 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 (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-10202372-B2 Trisubstituted pyrido[2,3-D]pyrimidines, methods for preparing same and therapeutic uses thereof DPYD, TYMP, RRM2B HIF1A 2313/4885GABRA1 2475/4885LMNA 3069/4885

“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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