SCHEMBL362640

SCHEMBL362640

COc1ccc(COc2cc([N+](=O)[O-])ccc2Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 12/20 0.64
CNR2 P34972 2/20 0.55
MAPT P10636 3/20 0.52
MEN1 O00255 1/20 0.52
CRHBP P24387 1/20 0.52
KMT2A Q03164 1/20 0.52
CRHR2 Q13324 1/20 0.52
GAA P10253 1/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HPGD P15428 1/20 0.49
CNR1 P21554 1/20 0.47
ACHE P22303 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
SCHEMBL30235425 1.00 CYP19A1 (0.64) CYP19A1CNR2MAPTMEN1CRHBP
SCHEMBL29719016 0.90 MAPT (0.61) CYP19A1CNR2MAPTMEN1CRHBP
SCHEMBL22983913 0.90 MAPT (0.61) CYP19A1CNR2MAPTMEN1CRHBP
SCHEMBL12381203 0.88 CYP19A1 (0.68) CYP19A1CNR2MAPTMEN1CRHBP
SCHEMBL3297532 0.85 CYP19A1 (0.65) CYP19A1CNR2MAPTMEN1CRHBP
SCHEMBL12952789 0.84 CYP19A1 (0.47) CYP19A1MAPTMEN1KMT2AHTT
SCHEMBL31442728 0.83 MEN1 (0.61) CYP19A1CNR2MAPTMEN1KMT2A
SCHEMBL944185 0.83 MEN1 (0.61) CYP19A1CNR2MAPTMEN1KMT2A
SCHEMBL7825236 0.83 CYP19A1 (0.62) CYP19A1CNR2MAPTMEN1CRHBP
SCHEMBL20607753 0.83 CYP19A1 (0.62) CYP19A1CNR2MAPTMEN1CRHBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111096967-B Antifungal agent F2G有限公司 2023-03-10 CN disclosed
US-11065228-B2 Antifungal agents F2G LIMITED (GB) 2021-07-20 US disclosed
US-11065228-B2 Antifungal agents F2G LIMITED (GB) 2021-07-20 US disclosed
US-20200179340-A1 ANTIFUNGAL AGENTS F2G LTD (GB) 2020-06-11 US disclosed
US-20200179340-A1 ANTIFUNGAL AGENTS F2G LTD (GB) 2020-06-11 US disclosed
CN-111096967-A Antifungal agent F2G有限公司 2020-05-05 CN disclosed
US-10596150-B2 Antifungal agents F2G LIMITED (GB) 2020-03-24 US disclosed
US-10596150-B2 Antifungal agents F2G LIMITED (GB) 2020-03-24 US disclosed
US-20190314333-A1 ANTIFUNGAL AGENTS F2G LTD (GB) 2019-10-17 US disclosed
US-20190314333-A1 ANTIFUNGAL AGENTS F2G LTD (GB) 2019-10-17 US disclosed
WO-2016079536-A1 ANTIFUNGAL AGENTS F2G LIMITED (GB) 2016-05-26 WO disclosed
US-9062066-B2 Anti-inflammatory compound having inhibitory activity against multiple tyrosine kinases and pharmaceutical composition containing same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2015-06-23 US disclosed
US-8637523-B2 Compounds for the reduction of beta-amyloid production BRISTOL-MYERS SQUIBB COMPANY (US) 2014-01-28 US disclosed
US-8637523-B2 Compounds for the reduction of beta-amyloid production BRISTOL-MYERS SQUIBB COMPANY (US) 2014-01-28 US disclosed
EP-2593461-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION Bristol-Myers Squibb Company (US) 2013-05-22 EP disclosed
US-20130072482-A1 ANTI-INFLAMMATORY COMPOUND HAVING INHIBITORY ACTIVITY AGAINST MULTIPLE TYROSINE KINASES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME PHAROSBIOMED CO., LTD. (KR) 2013-03-21 US disclosed
US-20120184565-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY 2012-07-19 US disclosed
US-20120184565-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY 2012-07-19 US disclosed
WO-2012009309-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2012-01-19 WO disclosed
WO-2012009309-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2012-01-19 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 (6 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-20130072482-A1 ANTI-INFLAMMATORY COMPOUND HAVING INHIBITORY ACTIVITY AGAINST MULTIPLE TYROSINE KINASES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME LCK, SRC, MAP3K1 CYP19A1 2415/4885CNR2 2278/4885MAPT 1230/4885
US-20200179340-A1 ANTIFUNGAL AGENTS DPM1, AADAC, PIK3C3 CYP19A1 2141/4885CNR2 1354/4885MAPT 3096/4885
US-20120184565-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION APP, BACE1, IAPP CYP19A1 2385/4885CNR2 3497/4885MAPT 14/4885
US-11065228-B2 Antifungal agents DPM1, AADAC, PIK3C3 CYP19A1 2141/4885CNR2 1354/4885MAPT 3096/4885
US-20190314333-A1 ANTIFUNGAL AGENTS DPM1, AADAC, PIK3C3 CYP19A1 2141/4885CNR2 1354/4885MAPT 3096/4885
US-10596150-B2 Antifungal agents DPM1, AADAC, PIK3C3 CYP19A1 2141/4885CNR2 1354/4885MAPT 3096/4885

“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.