SCHEMBL17113449

SCHEMBL17113449

O=C(c1ccc(F)cc1F)C(F)(F)c1ccc(-c2ccc(OCC(F)(F)F)cc2)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 9/20 0.50
▸ CYP2C9 P11712 5/20 0.50
▸ CYP2C19 P33261 5/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ SCN9A Q15858 1/20 0.41
▸ MEN1 O00255 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ GRM5 P41594 1/20 0.39
▸ DGAT1 O75907 1/20 0.37
▸ SCN8A Q9UQD0 1/20 0.37
▸ SCN10A Q9Y5Y9 1/20 0.37
▸ CHRNA7 P36544 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ PAX8 Q06710 1/20 0.36

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
SCHEMBL22296139 0.89 CYP3A4 (0.49) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL11917195 0.86 CYP3A4 (0.48) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL29061268 0.83 CYP3A4 (0.36) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL11913027 0.82 CES2 (0.40) CYP3A4CYP2C9CYP2C19LMNAHTT
SCHEMBL20903514 0.80 GAA (0.40) CYP3A4CYP2C9CYP2C19KDM4E
SCHEMBL14405706 0.78 CES2 (0.40) CYP2C9MAPTKDM4E
SCHEMBL16408541 0.78 CYP3A4 (0.59) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL18650595 0.76 MAP4K4 (0.38) —
SCHEMBL15584523 0.76 SLC22A12 (0.39) CYP3A4CYP2C19SCN9AMEN1LMNA
SCHEMBL14332118 0.76 CYP3A4 (0.43) CYP3A4LMNAKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116675672-A New preparation method of antifungal medicine 北京康立生医药技术开发有限公司 2023-09-01 — — CN claimed
CN-116675672-A New preparation method of antifungal medicine 北京康立生医药技术开发有限公司 2023-09-01 — — CN disclosed
CN-116675672-A New preparation method of antifungal medicine 北京康立生医药技术开发有限公司 2023-09-01 — — CN disclosed
US-10745378-B2 Antifungal compound process Mycovia Pharmaceuticals, Inc. (US) 2020-08-18 — — US disclosed
EP-3119745-B1 ANTIFUNGAL COMPOUND PROCESS MYCOVIA PHARMACEUTICALS INC (US) 2020-08-05 — — EP disclosed
US-10392365-B2 Antifungal compound process Mycovia Pharmaceuticals, Inc. (US) 2019-08-27 — — US disclosed
US-20190161469-A1 Antifungal Compound Process MYCOVIA PHARMACEUTICALS INC (US) 2019-05-30 — — US disclosed
US-20190161470-A1 Antifungal Compound Process MYCOVIA PHARMACEUTICALS INC (US) 2019-05-30 — — US disclosed
US-10196375-B2 Antifungal compound process Mycovia Pharmaceuticals, Inc. (US) 2019-02-05 — — US disclosed
US-10173998-B2 Antifungal compound process Mycovia Pharmaceuticals, Inc. (US) 2019-01-08 — — US disclosed
US-10000465-B2 Antifungal compound process Mycovia Pharmaceuticals, Inc. (US) 2018-06-19 — — US disclosed
US-20170088539-A1 ANTIFUNGAL COMPOUND PROCESS Mycovia Pharmaceuticals, Inc. 2017-03-30 — — US disclosed
US-20170081310-A1 ANTIFUNGAL COMPOUND PROCESS Mycovia Pharmaceuticals, Inc. 2017-03-23 — — US disclosed
WO-2015143172-A1 ANTIFUNGAL COMPOUND PROCESS VIAMET PHARMACEUTICALS, INC. (US) 2015-09-24 — — WO disclosed
WO-2015143142-A1 ANTIFUNGAL COMPOUND PROCESS VIAMET PHARMACEUTICALS, INC. (US) 2015-09-24 — — WO disclosed
WO-2015143180-A1 ANTIFUNGAL COMPOUND PROCESS VIAMET PHARMACEUTICALS, INC. (US) 2015-09-24 — — 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 (9 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-10392365-B2 Antifungal compound process ERG28, DPM1, CYP51A1 CYP3A4 19/4885CYP2C9 307/4885CYP2C19 290/4885
US-10000465-B2 Antifungal compound process ERG28, DPM1, CYP51A1 CYP3A4 19/4885CYP2C9 307/4885CYP2C19 290/4885
US-10745378-B2 Antifungal compound process ERG28, DPM1, CYP51A1 CYP3A4 19/4885CYP2C9 307/4885CYP2C19 290/4885
US-10173998-B2 Antifungal compound process ERG28, DPM1, CYP51A1 CYP3A4 19/4885CYP2C9 307/4885CYP2C19 290/4885
US-20170081310-A1 ANTIFUNGAL COMPOUND PROCESS ERG28, DPM1, CYP51A1 CYP3A4 19/4885CYP2C9 307/4885CYP2C19 290/4885
US-20170088539-A1 ANTIFUNGAL COMPOUND PROCESS ERG28, DPM1, CYP51A1 CYP3A4 19/4885CYP2C9 307/4885CYP2C19 290/4885
US-20190161470-A1 Antifungal Compound Process ERG28, DPM1, CYP51A1 CYP3A4 19/4885CYP2C9 307/4885CYP2C19 290/4885
US-20190161469-A1 Antifungal Compound Process ERG28, DPM1, CYP51A1 CYP3A4 19/4885CYP2C9 307/4885CYP2C19 290/4885
US-10196375-B2 Antifungal compound process ERG28, DPM1, CYP51A1 CYP3A4 19/4885CYP2C9 307/4885CYP2C19 290/4885

“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.

Send feedback