SCHEMBL269849

SCHEMBL269849

CC(C)(C)C(O)(COc1ccc(Cl)cc1)Cn1cncn1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.66
CYP3A4 P08684 2/20 0.66
KMT2A Q03164 5/20 0.49
TSHR P16473 1/20 0.45
HSP90AA1 P07900 2/20 0.44
POLB P06746 2/20 0.44
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 4/20 0.41
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
HTT P42858 1/20 0.39

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
SCHEMBL10391870 0.89 ALDH1A1 (0.68) ALDH1A1CYP3A4KMT2ATSHRPOLB
SCHEMBL9007847 0.89 ALDH1A1 (0.68) ALDH1A1CYP3A4KMT2ATSHRHSP90AA1
SCHEMBL10469561 0.89 ALDH1A1 (0.51) ALDH1A1CYP3A4KMT2AHSP90AA1MAPT
SCHEMBL10631729 0.88 ALDH1A1 (0.55) ALDH1A1CYP3A4KMT2ATSHRHSP90AA1
SCHEMBL10366604 0.88 ALDH1A1 (0.55) ALDH1A1CYP3A4KMT2ATSHRHSP90AA1
SCHEMBL10422763 0.88 CYP3A4 (0.55) ALDH1A1CYP3A4KMT2ATSHRHSP90AA1
SCHEMBL10408719 0.88 ALDH1A1 (0.55) ALDH1A1CYP3A4KMT2ATSHRHSP90AA1
SCHEMBL10638069 0.88 ALDH1A1 (0.55) ALDH1A1CYP3A4KMT2ATSHRHSP90AA1
SCHEMBL9770404 0.88 ALDH1A1 (0.57) ALDH1A1CYP3A4KMT2ATSHRHSP90AA1
SCHEMBL950886 0.88 ALDH1A1 (0.50) ALDH1A1CYP3A4KMT2AHSP90AA1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020193369-A1 Antifungal compounds and uses therefor PROTEZ PHARMACEUTICALS INC. 2002-12-19 US claimed
WO-2002036203-A2 AZOLE CONTAINING COMPOSITIONS WITH ENHANCED ANTIFUNGAL ACTIVITY INFLUX, INC. (US) 2002-05-10 WO claimed
EP-0538442-B1 METHOD FOR IMPROVING THE THERAPEUTIC EFFICIENCY OF LIPOSOLUBLE ANTIFUNGAL AGENTS FROM THE IMIDAZOLE FAMILY, AND COMPOSITION FOR IMPLEMENTING SAME OREAL (FR) 1995-06-21 EP claimed
EP-0538442-A1 METHOD FOR IMPROVING THE THERAPEUTIC EFFICIENCY OF LIPOSOLUBLE ANTIFUNGAL AGENTS FROM THE IMIDAZOLE FAMILY, AND COMPOSITION FOR IMPLEMENTING SAME. OREAL (FR) 1993-04-28 EP claimed
WO-1992019225-A1 METHOD FOR IMPROVING THE THERAPEUTIC EFFICIENCY OF LIPOSOLUBLE ANTIFUNGAL AGENTS FROM THE IMIDAZOLE FAMILY, AND COMPOSITION FOR IMPLEMENTING SAME L'OREAL (FR) 1992-11-12 WO claimed
EP-0315861-B1 ANTIMYCOTIC COMPOSITIONS OF A NIKKOMYCIN COMPOUND AND AN ANTIMYCOTIC AZOLE BAYER AG (DE) 1992-01-29 EP claimed
EP-0310122-B1 ANTIFUNGAL COMPOSITION KAKEN PHARMACEUTICAL CO., LTD. (JP) 1991-07-24 EP claimed
EP-0181529-B1 Optically active 2-(4-chloro-phenoxymethly)-3, 3-dimethyl-1-(1,2,4-triazol-1-yl)-2-butanol, process for its preparation as well as its use as an antimycotic agent. BAYER AG (DE) 1991-03-27 EP claimed
EP-0224077-B1 PLANT GROWTH REGULATING AGENT BAYER AG (DE) 1990-08-08 EP claimed
US-4897107-A PLANT GROWTH REGULATORS; FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1990-01-30 US claimed
EP-0310122-A1 Antifungal composition KAKEN PHARMACEUTICAL CO., LTD. (JP) 1989-04-05 EP claimed
US-4783538-A PLANT GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1988-11-08 US claimed
EP-0224077-A1 Plant growth regulating agent BAYER AG (DE) 1987-06-03 EP claimed
EP-0181529-A2 Optically active 2-(4-chloro-phenoxymethly)-3, 3-dimethyl-1-(1,2,4-triazol-1-yl)-2-butanol, process for its preparation as well as its use as an antimycotic agent. BAYER AG (DE) 1986-05-21 EP claimed
US-4564622-A Triazole derivative as an antiviral agent BAYER AKTIENGESELLSCHAFT (DE) 1986-01-14 US claimed
US-12590963-B2 Anti-cancer treatment of preselected subjects and screening methods to identify susceptible subjects TUDAG TU DRESDEN AKTIENGESELLSCHAFT (DE) 2026-03-31 US disclosed
US-20230293492-A1 METHODS AND COMPOSITIONS FOR TREATING CUTANEOUS FUNGAL INFECTIONS PROPEDIX, INC. 2023-09-21 US disclosed
EP-0057357-A2 Plant growth stunting agent BAYER AG (DE) 1982-08-11 EP disclosed
EP-0043419-A1 Antimycotic composition BAYER AG (DE) 1982-01-13 EP disclosed
EP-0040345-A1 1-Hydroxyethyl-azole derivatives, process for their preparation and their use in the regulation of plant growth and as fungicides BAYER AG (DE) 1981-11-25 EP 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-20020193369-A1 Antifungal compounds and uses therefor CYP51A1, ERG28, TPP1 ALDH1A1 1449/4885CYP3A4 18/4885KMT2A 2672/4885
US-12590963-B2 Anti-cancer treatment of preselected subjects and screening methods to identify susceptible subjects TPM4, TPM3, TAGLN2 ALDH1A1 2279/4885CYP3A4 171/4885KMT2A 4500/4885

“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.