SCHEMBL5934

SCHEMBL5934

COC(=O)c1ccc([N+](=O)[O-])c(F)c1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 1/20 0.58
ATM Q13315 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
HPGD P15428 2/20 0.50
ALDH1A1 P00352 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
PKM P14618 1/20 0.49
AKR1C4 P17516 1/20 0.49
AKR1C3 P42330 1/20 0.49
AKR1C2 P52895 1/20 0.49
AKR1C1 Q04828 1/20 0.49
WDR5 P61964 1/20 0.48
LMNA P02545 1/20 0.48
ERN1 O75460 1/20 0.48
POLB P06746 1/20 0.48
AR P10275 1/20 0.47
PELP1 Q8IZL8 1/20 0.47
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 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
SCHEMBL29556186 1.00 VCAM1 (0.58) VCAM1ATMTDP1HPGDALDH1A1
SCHEMBL31493 0.87 VCAM1 (0.62) VCAM1HPGDALDH1A1NPSR1PKM
SCHEMBL29564693 0.87 VCAM1 (0.62) VCAM1HPGDALDH1A1NPSR1PKM
SCHEMBL19058470 0.87 CA1 (0.49) VCAM1ATMTDP1HPGDALDH1A1
SCHEMBL13676425 0.85 CA1 (0.47) VCAM1ATMTDP1HPGDALDH1A1
SCHEMBL5734347 0.85 VCAM1 (0.68) VCAM1HPGDALDH1A1NPSR1PKM
SCHEMBL29966142 0.83 ATM (0.47) VCAM1ATMTDP1HPGDALDH1A1
SCHEMBL30663390 0.83 CTSK (0.48) VCAM1ATMTDP1ALDH1A1NPSR1
SCHEMBL357203 0.83 ATM (0.47) VCAM1ATMTDP1HPGDALDH1A1
SCHEMBL692577 0.83 KMT2A (0.60) ATMTDP1ALDH1A1PKMLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4748839-A1 POLYCYCLIC COMPOUND AND USE THEREOF CSPC Zhongqi Pharmaceutical Technology (Shijiazhuang) Co., Ltd. (CN) 2026-05-27 EP disclosed
US-20260138990-A1 TRICYCLIC FUSED IMIDAZOLE COMPOUNDS AS CD38 MODULATORS AND USES THEREOF AEOVIAN PHARMACEUTICALS INC (US) 2026-05-21 US disclosed
CN-122070134-A Use of PRMT5 inhibitors in the treatment of tumors or cancers 上海湃隆生物科技有限公司 2026-05-19 CN disclosed
EP-4355748-B1 SUBSTITUTED PYRROLO[2,3-D]PYRIMIDINES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI SA (FR) 2026-05-13 EP disclosed
US-20260125380-A1 PRMT5 INHIBITORS AND METHODS OF USE SHANGHAI APEIRON THERAPEUTICS COMPANY LIMITED (CN) 2026-05-07 US disclosed
EP-4732837-A2 NOVEL PRMT5 INHIBITORS Amgen Inc. (US) 2026-04-29 EP disclosed
US-12611401-B2 Combinations comprising benzodioxol as GLP-1R agonists for use in the treatment of NASH/NAFLD and related diseases PFIZER INC. (US) 2026-04-28 US disclosed
US-12595249-B2 Aryl ether-substituted heterocyclic compounds as glpir agonists MINDRANK AI LTD. (CN) 2026-04-07 US disclosed
EP-4263545-B1 PRMT5 INHIBITORS AMGEN INC (US) 2026-04-01 EP disclosed
EP-4384268-B1 SMALL MOLECULE UREA DERIVATIVES AS STING ANTAGONISTS CURADEV PHARMA PVT LTD (IN) 2026-03-18 EP disclosed
WO-2003024921-A1 ALKYL UREA RETINOID AGONISTS I F. HOFFMANN-LA ROCHE AG (CH) 2003-03-27 WO disclosed
US-6313302-B2 OPIOID KAPPA RECEPTOR ANTAGONISTS; SIDE EFFECT REDUCTION; ANALGESICS, ANTIINFLAMMATORY AGENTS, ANESTHETICS, AND NEUROPROTECTANTS PFIZER INC. 2001-11-06 US disclosed
US-6303602-B1 USEFUL AS ANALGESIC, ANESTHETIC, ANTI-INFLAMMATORY OR NEUROPROTECTIVE AGENT, OR FOR THERAPY OF ARTHRITIS, STROKE OF FUNCTIONAL BOWEL DISEASE PFIZER INC. 2001-10-16 US disclosed
US-20010014683-A1 Analgesics; side effect reduction ITO FUMITAKA (JP) 2001-08-16 US disclosed
US-20010008890-A1 Useful as analgesic, anesthetic, antiinflammatory or neuroprotective agents and in treatment of arthritis, stroke, bowel disease ITO FUMITAKA (JP) 2001-07-19 US disclosed
CN-1237962-A Pyrrolidinyl and pyrrolinyl ethylamine compounds as K agonists PFIZER (US) 1999-12-08 CN disclosed
EP-0747347-B1 RAR-gamma-specific retinobenzoic acid derivatives BRISTOL MYERS SQUIBB CO (US) 1999-07-21 EP disclosed
US-5760084-A TREATING DERMATOLOGICAL DISORDERS BRISTOL-MYERS SQUIBB COMPANY (US) 1998-06-02 US disclosed
US-5624957-A RETINOID ACTIVE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 1997-04-29 US disclosed
EP-0747347-A1 RARy-specific retinobenzoic acid derivatives BRISTOL-MYERS SQUIBB COMPANY (US) 1996-12-11 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 (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-20260138990-A1 TRICYCLIC FUSED IMIDAZOLE COMPOUNDS AS CD38 MODULATORS AND USES THEREOF CD38, BCL9, BCL6B VCAM1 292/4885ATM 3286/4885TDP1 1618/4885
US-12595249-B2 Aryl ether-substituted heterocyclic compounds as glpir agonists GLP1R, GIPR, GCGR VCAM1 2040/4885ATM 3566/4885TDP1 3936/4885
US-20260125380-A1 PRMT5 INHIBITORS AND METHODS OF USE PRMT1, PRMT5, PRMT6 VCAM1 3977/4885ATM 1274/4885TDP1 808/4885
US-12611401-B2 Combinations comprising benzodioxol as GLP-1R agonists for use in the treatment of NASH/NAFLD and related diseases GLP1R, GCKR, GPR119 VCAM1 1878/4885ATM 2365/4885TDP1 4430/4885
US-20010014683-A1 Analgesics; side effect reduction OPRL1, OPRK1, OPRD1 VCAM1 3681/4885ATM 4822/4885TDP1 2897/4885
US-20010008890-A1 Useful as analgesic, anesthetic, antiinflammatory or neuroprotective agents and in treatment of arthritis, stroke, bowel disease OPRL1, NAP1L1, OPRK1 VCAM1 849/4885ATM 4812/4885TDP1 1486/4885

“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.