SCHEMBL334475

SCHEMBL334475

NC(CO)Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
LMNA P02545 1/20 0.55
LOXL2 Q9Y4K0 1/20 0.55
DPP4 P27487 1/20 0.52
DPP7 Q9UHL4 1/20 0.52
IDO1 P14902 4/20 0.50
ALDH1A1 P00352 2/20 0.49
CYP2C19 P33261 1/20 0.49
ANPEP P15144 1/20 0.46
ERAP2 Q6P179 1/20 0.46
ERAP1 Q9NZ08 1/20 0.46
AKR1C3 P42330 1/20 0.45
GSK3B P49841 1/20 0.44
POLB P06746 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
MMP2 P08253 1/20 0.44
EPHX1 P07099 1/20 0.43

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
SCHEMBL8186292 1.00 TSHR (0.56) TSHRLMNALOXL2DPP4DPP7
SCHEMBL1176909 1.00 TSHR (0.56) TSHRLMNALOXL2DPP4DPP7
Hydrochloric Acid SCHEMBL4360113 0.98 TSHR (0.55) TSHRLMNALOXL2DPP4DPP7
SCHEMBL29254192 0.86 LMNA (0.50) TSHRLMNALOXL2DPP4DPP7
SCHEMBL514488 0.85 LOXL2 (0.60) TSHRLMNALOXL2DPP4DPP7
SCHEMBL5148823 0.85 LOXL2 (0.60) TSHRLMNALOXL2DPP4DPP7
SCHEMBL13014394 0.84 TSHR (0.61) TSHRLMNALOXL2IDO1ALDH1A1
Hydrochloric Acid SCHEMBL9355954 0.84 LOXL2 (0.58) TSHRLMNALOXL2DPP4DPP7
SCHEMBL16093322 0.84 LOXL2 (0.53) TSHRLMNALOXL2DPP4DPP7
SCHEMBL16790561 0.84 LOXL2 (0.53) TSHRLMNALOXL2DPP4DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103275075-B Zolmitriptan and preparation method thereof CHENGDU TIANTAISHAN PHARMACEUTICAL CO LTD 2015-01-07 CN claimed
CN-103275075-A Zolmitriptan and preparation method thereof CHENGDU TIANTAISHAN PHARMACEUTICAL CO LTD 2013-09-04 CN claimed
CN-101693710-A Method for preparing Zolmitriptan SUZHOU LEADER CHEMICAL CO LTD 2010-04-14 CN claimed
WO-2008018090-A2 AN IMPROVED PROCESS FOR THE PREPARATION OF ZOLMITRIPTAN MATRIX LABORATORIES LTD (IN) 2008-02-14 WO claimed
US-20250049937-A1 NOVEL AURISTATIN ANALOGS AND IMMUNOCONJUGATES THEREOF ADCENTRX THERAPEUTICS INC (US) 2025-02-13 US disclosed
EP-4453000-A1 NOVEL AURISTATIN ANALOGS AND IMMUNOCONJUGATES THEREOF Adcentrx Therapeutics Inc. (US) 2024-10-30 EP disclosed
EP-3515896-B1 CHIRAL CYCLEN COMPOUNDS AND THEIR USES UNIV HONG KONG POLYTECHNIC (CN) 2024-08-21 EP disclosed
CN-116574014-A Preparation method of zolmitriptan intermediate 山东锐顺药业有限公司 2023-08-11 CN disclosed
WO-2023122228-A1 NOVEL AURISTATIN ANALOGS AND IMMUNOCONJUGATES THEREOF ADCENTRX THERAPEUTICS INC. (US) 2023-06-29 WO disclosed
WO-2023122228-A1 NOVEL AURISTATIN ANALOGS AND IMMUNOCONJUGATES THEREOF ADCENTRX THERAPEUTICS INC. (US) 2023-06-29 WO disclosed
US-11357873-B2 Chiral cyclen compounds and their uses THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2022-06-14 US disclosed
US-20210283278-A1 CHIRAL CYCLEN COMPOUNDS AND THEIR USES THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2021-09-16 US disclosed
EP-0636623-B1 Indole derivatives as 5-HT1- like agonists ASTRAZENECA AB (SE) 2001-08-16 EP disclosed
EP-1092435-A1 REMEDIES FOR DIABETES KYOWA HAKKO KOGYO CO., LTD. (JP) 2001-04-18 EP disclosed
WO-2000018770-A1 PYRROLOPYRROLONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXO GROUP LIMITED (GB) 2000-04-06 WO disclosed
US-5863935-A SYNTHESIS OF INDOLE DERIVATIVES OF HETEROCYCLIC COMPOUNDS FOR TREATMENT OF HEADACHES AND MIGRAINES ZENECA LIMITED (GB) 1999-01-26 US disclosed
EP-0486666-B1 THERAPEUTIC HETEROCYCLIC COMPOUNDS ZENECA LTD (GB) 1997-08-13 EP disclosed
US-5466699-A Indolyl compounds for treating migraine BURROUGHS WELLCOME CO. (US) 1995-11-14 US disclosed
US-5399574-A 5-hydroxytryptamine agonists; vasoconstrictors BURROUGHS WELLCOME CO. (US) 1995-03-21 US disclosed
EP-0636623-A1 Indole derivatives as 5-HT1- like agonists THE WELLCOME FOUNDATION LIMITED (GB) 1995-02-01 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 (3 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-20250049937-A1 NOVEL AURISTATIN ANALOGS AND IMMUNOCONJUGATES THEREOF AURKC, AURKA, AURKB TSHR 3325/4885LMNA 3626/4885LOXL2 4382/4885
US-11357873-B2 Chiral cyclen compounds and their uses DCTN3, DCTN1, CDK3 TSHR 845/4885LMNA 2197/4885LOXL2 4681/4885
US-20210283278-A1 CHIRAL CYCLEN COMPOUNDS AND THEIR USES DCTN3, DCTN1, CDK3 TSHR 845/4885LMNA 2197/4885LOXL2 4681/4885

“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.